bis(5-chloro-2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);1-[(1S,2S)-2-methoxycyclobutyl]-3-(2-methylpropyl)pyridin-2-one;bis(2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);1-[(1R,2S)-2-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1S,3S)-3-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1R,3S)-3-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;bis(1-(4-methoxycyclohexyl)-3-(2-methylpropyl)pyridin-2-one);1-[(1S,2S)-2-methoxycyclopentyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1R,2S)-2-methoxycyclopentyl]-3-(2-methylpropyl)pyridin-2-one;2-[(3S)-3-methoxypyrrolidin-1-yl]-6-(2-methylpropyl)pyridine;N-methyl-4-(propan-2-ylamino)-1,2-thiazole-3-carboxamide

C198H305Cl2N21O26S — CID 159069964

IUPACbis(5-chloro-2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);1-[(1S,2S)-2-methoxycyclobutyl]-3-(2-methylpropyl)pyridin-2-one;bis(2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);1-[(1R,2S)-2-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1S,3S)-3-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1R,3S)-3-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;bis(1-(4-methoxycyclohexyl)-3-(2-methylpropyl)pyridin-2-one);1-[(1S,2S)-2-methoxycyclopentyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1R,2S)-2-methoxycyclopentyl]-3-(2-methylpropyl)pyridin-2-one;2-[(3S)-3-methoxypyrrolidin-1-yl]-6-(2-methylpropyl)pyridine;N-methyl-4-(propan-2-ylamino)-1,2-thiazole-3-carboxamide
SMILESCNC(=O)c1nscc1NC(C)C.COC1CC(Oc2ncc(Cl)cc2NC(C)C)C1.COC1CC(Oc2ncc(Cl)cc2NC(C)C)C1.COC1CC(Oc2ncccc2NC(C)C)C1.COC1CC(Oc2ncccc2NC(C)C)C1.COC1CCC(n2cccc(CC(C)C)c2=O)CC1.COC1CCC(n2cccc(CC(C)C)c2=O)CC1.CO[C@H]1CCCC[C@H]1n1cccc(CC(C)C)c1=O.CO[C@H]1CCC[C@@H](n2cccc(CC(C)C)c2=O)C1.CO[C@H]1CCC[C@@H]1n1cccc(CC(C)C)c1=O.CO[C@H]1CCC[C@H](n2cccc(CC(C)C)c2=O)C1.CO[C@H]1CCC[C@H]1n1cccc(CC(C)C)c1=O.CO[C@H]1CCN(c2cccc(CC(C)C)n2)C1.CO[C@H]1CC[C@@H]1n1cccc(CC(C)C)c1=O
InChIInChI=1S/5C16H25NO2.2C15H23NO2.C14H22N2O.C14H21NO2.2C13H19ClN2O2.2C13H20N2O2.C8H13N3OS/c2*1-12(2)10-13-6-5-9-17(16(13)18)14-7-4-8-15(11-14)19-3;2*1-12(2)11-13-5-4-10-17(16(13)18)14-6-8-15(19-3)9-7-14;1-12(2)11-13-7-6-10-17(16(13)18)14-8-4-5-9-15(14)19-3;2*1-11(2)10-12-6-5-9-16(15(12)17)13-7-4-8-14(13)18-3;1-11(2)9-12-5-4-6-14(15-12)16-8-7-13(10-16)17-3;1-10(2)9-11-5-4-8-15(14(11)16)12-6-7-13(12)17-3;2*1-8(2)16-12-4-9(14)7-15-13(12)18-11-5-10(6-11)17-3;2*1-9(2)15-12-5-4-6-14-13(12)17-11-7-10(8-11)16-3;1-5(2)10-6-4-13-11-7(6)8(12)9-3/h2*5-6,9,12,14-15H,4,7-8,10-11H2,1-3H3;2*4-5,10,12,14-15H,6-9,11H2,1-3H3;6-7,10,12,14-15H,4-5,8-9,11H2,1-3H3;2*5-6,9,11,13-14H,4,7-8,10H2,1-3H3;4-6,11,13H,7-10H2,1-3H3;4-5,8,10,12-13H,6-7,9H2,1-3H3;2*4,7-8,10-11,16H,5-6H2,1-3H3;2*4-6,9-11,15H,7-8H2,1-3H3;4-5,10H,1-3H3,(H,9,12)/t14-,15+;14-,15-;;;14-,15+;13-,14+;13-,14-;13-;12-,13-;;;;;/m10..11000...../s1
InChIKeyJZNFCOJOZVFRAA-RDBJOWFNSA-N
MW3498.71 g/mol
LogP38.82
Rot. Bonds59

About bis(5-chloro-2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);1-[(1S,2S)-2-methoxycyclobutyl]-3-(2-methylpropyl)pyridin-2-one;bis(2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);1-[(1R,2S)-2-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1S,3S)-3-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1R,3S)-3-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;bis(1-(4-methoxycyclohexyl)-3-(2-methylpropyl)pyridin-2-one);1-[(1S,2S)-2-methoxycyclopentyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1R,2S)-2-methoxycyclopentyl]-3-(2-methylpropyl)pyridin-2-one;2-[(3S)-3-methoxypyrrolidin-1-yl]-6-(2-methylpropyl)pyridine;N-methyl-4-(propan-2-ylamino)-1,2-thiazole-3-carboxamide

bis(5-chloro-2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);1-[(1S,2S)-2-methoxycyclobutyl]-3-(2-methylpropyl)pyridin-2-one;bis(2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);1-[(1R,2S)-2-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1S,3S)-3-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1R,3S)-3-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;bis(1-(4-methoxycyclohexyl)-3-(2-methylpropyl)pyridin-2-one);1-[(1S,2S)-2-methoxycyclopentyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1R,2S)-2-methoxycyclopentyl]-3-(2-methylpropyl)pyridin-2-one;2-[(3S)-3-methoxypyrrolidin-1-yl]-6-(2-methylpropyl)pyridine;N-methyl-4-(propan-2-ylamino)-1,2-thiazole-3-carboxamide (PubChem CID 159069964) has the molecular formula C198H305Cl2N21O26S and a molecular weight of 3498.71 g/mol. Its IUPAC name is bis(5-chloro-2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);1-[(1S,2S)-2-methoxycyclobutyl]-3-(2-methylpropyl)pyridin-2-one;bis(2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);1-[(1R,2S)-2-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1S,3S)-3-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1R,3S)-3-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;bis(1-(4-methoxycyclohexyl)-3-(2-methylpropyl)pyridin-2-one);1-[(1S,2S)-2-methoxycyclopentyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1R,2S)-2-methoxycyclopentyl]-3-(2-methylpropyl)pyridin-2-one;2-[(3S)-3-methoxypyrrolidin-1-yl]-6-(2-methylpropyl)pyridine;N-methyl-4-(propan-2-ylamino)-1,2-thiazole-3-carboxamide.

Molecular Properties

Compound Namebis(5-chloro-2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);1-[(1S,2S)-2-methoxycyclobutyl]-3-(2-methylpropyl)pyridin-2-one;bis(2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);1-[(1R,2S)-2-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1S,3S)-3-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1R,3S)-3-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;bis(1-(4-methoxycyclohexyl)-3-(2-methylpropyl)pyridin-2-one);1-[(1S,2S)-2-methoxycyclopentyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1R,2S)-2-methoxycyclopentyl]-3-(2-methylpropyl)pyridin-2-one;2-[(3S)-3-methoxypyrrolidin-1-yl]-6-(2-methylpropyl)pyridine;N-methyl-4-(propan-2-ylamino)-1,2-thiazole-3-carboxamide
PubChem CID159069964
Molecular FormulaC198H305Cl2N21O26S
Molecular Weight3498.71 g/mol
Exact Mass3495.23
IUPAC Namebis(5-chloro-2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);1-[(1S,2S)-2-methoxycyclobutyl]-3-(2-methylpropyl)pyridin-2-one;bis(2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);1-[(1R,2S)-2-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1S,3S)-3-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1R,3S)-3-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;bis(1-(4-methoxycyclohexyl)-3-(2-methylpropyl)pyridin-2-one);1-[(1S,2S)-2-methoxycyclopentyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1R,2S)-2-methoxycyclopentyl]-3-(2-methylpropyl)pyridin-2-one;2-[(3S)-3-methoxypyrrolidin-1-yl]-6-(2-methylpropyl)pyridine;N-methyl-4-(propan-2-ylamino)-1,2-thiazole-3-carboxamide
SMILESCNC(=O)c1nscc1NC(C)C.COC1CC(Oc2ncc(Cl)cc2NC(C)C)C1.COC1CC(Oc2ncc(Cl)cc2NC(C)C)C1.COC1CC(Oc2ncccc2NC(C)C)C1.COC1CC(Oc2ncccc2NC(C)C)C1.COC1CCC(n2cccc(CC(C)C)c2=O)CC1.COC1CCC(n2cccc(CC(C)C)c2=O)CC1.CO[C@H]1CCCC[C@H]1n1cccc(CC(C)C)c1=O.CO[C@H]1CCC[C@@H](n2cccc(CC(C)C)c2=O)C1.CO[C@H]1CCC[C@@H]1n1cccc(CC(C)C)c1=O.CO[C@H]1CCC[C@H](n2cccc(CC(C)C)c2=O)C1.CO[C@H]1CCC[C@H]1n1cccc(CC(C)C)c1=O.CO[C@H]1CCN(c2cccc(CC(C)C)n2)C1.CO[C@H]1CC[C@@H]1n1cccc(CC(C)C)c1=O
InChIInChI=1S/5C16H25NO2.2C15H23NO2.C14H22N2O.C14H21NO2.2C13H19ClN2O2.2C13H20N2O2.C8H13N3OS/c2*1-12(2)10-13-6-5-9-17(16(13)18)14-7-4-8-15(11-14)19-3;2*1-12(2)11-13-5-4-10-17(16(13)18)14-6-8-15(19-3)9-7-14;1-12(2)11-13-7-6-10-17(16(13)18)14-8-4-5-9-15(14)19-3;2*1-11(2)10-12-6-5-9-16(15(12)17)13-7-4-8-14(13)18-3;1-11(2)9-12-5-4-6-14(15-12)16-8-7-13(10-16)17-3;1-10(2)9-11-5-4-8-15(14(11)16)12-6-7-13(12)17-3;2*1-8(2)16-12-4-9(14)7-15-13(12)18-11-5-10(6-11)17-3;2*1-9(2)15-12-5-4-6-14-13(12)17-11-7-10(8-11)16-3;1-5(2)10-6-4-13-11-7(6)8(12)9-3/h2*5-6,9,12,14-15H,4,7-8,10-11H2,1-3H3;2*4-5,10,12,14-15H,6-9,11H2,1-3H3;6-7,10,12,14-15H,4-5,8-9,11H2,1-3H3;2*5-6,9,11,13-14H,4,7-8,10H2,1-3H3;4-6,11,13H,7-10H2,1-3H3;4-5,8,10,12-13H,6-7,9H2,1-3H3;2*4,7-8,10-11,16H,5-6H2,1-3H3;2*4-6,9-11,15H,7-8H2,1-3H3;4-5,10H,1-3H3,(H,9,12)/t14-,15+;14-,15-;;;14-,15+;13-,14+;13-,14-;13-;12-,13-;;;;;/m10..11000...../s1
InChIKeyJZNFCOJOZVFRAA-RDBJOWFNSA-N
XLogP38.82
TPSA502.74 Ų
H-Bond Donors6
H-Bond Acceptors47
Rotatable Bonds59
Heavy Atoms248
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003498.71
LogP ≤ 538.82
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1047

Analyze bis(5-chloro-2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);1-[(1S,2S)-2-methoxycyclobutyl]-3-(2-methylpropyl)pyridin-2-one;bis(2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);1-[(1R,2S)-2-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1S,3S)-3-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1R,3S)-3-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;bis(1-(4-methoxycyclohexyl)-3-(2-methylpropyl)pyridin-2-one);1-[(1S,2S)-2-methoxycyclopentyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1R,2S)-2-methoxycyclopentyl]-3-(2-methylpropyl)pyridin-2-one;2-[(3S)-3-methoxypyrrolidin-1-yl]-6-(2-methylpropyl)pyridine;N-methyl-4-(propan-2-ylamino)-1,2-thiazole-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

bis(5-chloro-2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);1-[(1S,2S)-2-methoxycyclobutyl]-3-(2-methylpropyl)pyridin-2-one;bis(2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);bis(1-(4-methoxycyclohexyl)-3-(2-methylpropyl)pyridin-2-one);2-[(3S)-3-methoxypyrrolidin-1-yl]-6-(2-methylpropyl)pyridine;N-methyl-3-(propan-2-ylamino)furan-2-carboxamide;N-methyl-4-(propan-2-ylamino)-1,2-thiazole-3-carboxamide;1-methyl-N-propan-2-ylpyrazol-4-amine;3-(2-methylpropyl)-1-(2-methylpyrazol-3-yl)pyridin-2-one
CID 158102150
5-chloro-2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine;1-[(1S,2S)-2-methoxycyclobutyl]-3-(2-methylpropyl)pyridin-2-one;bis(2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);1-[(1R,2S)-2-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1S,3S)-3-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1R,3S)-3-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;bis(1-(4-methoxycyclohexyl)-3-(2-methylpropyl)pyridin-2-one);1-[(1S,2S)-2-methoxycyclopentyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1R,2S)-2-methoxycyclopentyl]-3-(2-methylpropyl)pyridin-2-one;2-[(3S)-3-methoxypyrrolidin-1-yl]-6-(2-methylpropyl)pyridine
CID 158423691
bis(5-chloro-2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);1-[(1S,2S)-2-methoxycyclobutyl]-3-(2-methylpropyl)pyridin-2-one;bis(2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);tris(1-(4-methoxycyclohexyl)-3-(2-methylpropyl)pyridin-2-one);N-methyl-3-(propan-2-ylamino)furan-2-carboxamide;N-methyl-4-(propan-2-ylamino)-1,2-thiazole-3-carboxamide;1-methyl-N-propan-2-ylpyrazol-4-amine;3-(2-methylpropyl)-1-(2-methylpyrazol-3-yl)pyridin-2-one
CID 159979823
bis(5-chloro-2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);1-[(1S,2S)-2-methoxycyclobutyl]-3-(2-methylpropyl)pyridin-2-one;bis(2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);bis(1-(4-methoxycyclohexyl)-3-(2-methylpropyl)pyridin-2-one);N-methyl-3-(propan-2-ylamino)furan-2-carboxamide;N-methyl-4-(propan-2-ylamino)-1,2-thiazole-3-carboxamide;1-methyl-N-propan-2-ylpyrazol-4-amine;3-(2-methylpropyl)-1-(2-methylpyrazol-3-yl)pyridin-2-one
CID 160877348

Frequently Asked Questions

What is the IUPAC name of bis(5-chloro-2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);1-[(1S,2S)-2-methoxycyclobutyl]-3-(2-methylpropyl)pyridin-2-one;bis(2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);1-[(1R,2S)-2-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1S,3S)-3-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1R,3S)-3-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;bis(1-(4-methoxycyclohexyl)-3-(2-methylpropyl)pyridin-2-one);1-[(1S,2S)-2-methoxycyclopentyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1R,2S)-2-methoxycyclopentyl]-3-(2-methylpropyl)pyridin-2-one;2-[(3S)-3-methoxypyrrolidin-1-yl]-6-(2-methylpropyl)pyridine;N-methyl-4-(propan-2-ylamino)-1,2-thiazole-3-carboxamide?
The IUPAC name of bis(5-chloro-2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);1-[(1S,2S)-2-methoxycyclobutyl]-3-(2-methylpropyl)pyridin-2-one;bis(2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);1-[(1R,2S)-2-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1S,3S)-3-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1R,3S)-3-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;bis(1-(4-methoxycyclohexyl)-3-(2-methylpropyl)pyridin-2-one);1-[(1S,2S)-2-methoxycyclopentyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1R,2S)-2-methoxycyclopentyl]-3-(2-methylpropyl)pyridin-2-one;2-[(3S)-3-methoxypyrrolidin-1-yl]-6-(2-methylpropyl)pyridine;N-methyl-4-(propan-2-ylamino)-1,2-thiazole-3-carboxamide (CID 159069964) is bis(5-chloro-2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);1-[(1S,2S)-2-methoxycyclobutyl]-3-(2-methylpropyl)pyridin-2-one;bis(2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);1-[(1R,2S)-2-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1S,3S)-3-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1R,3S)-3-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;bis(1-(4-methoxycyclohexyl)-3-(2-methylpropyl)pyridin-2-one);1-[(1S,2S)-2-methoxycyclopentyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1R,2S)-2-methoxycyclopentyl]-3-(2-methylpropyl)pyridin-2-one;2-[(3S)-3-methoxypyrrolidin-1-yl]-6-(2-methylpropyl)pyridine;N-methyl-4-(propan-2-ylamino)-1,2-thiazole-3-carboxamide.
What is the SMILES notation for bis(5-chloro-2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);1-[(1S,2S)-2-methoxycyclobutyl]-3-(2-methylpropyl)pyridin-2-one;bis(2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);1-[(1R,2S)-2-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1S,3S)-3-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1R,3S)-3-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;bis(1-(4-methoxycyclohexyl)-3-(2-methylpropyl)pyridin-2-one);1-[(1S,2S)-2-methoxycyclopentyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1R,2S)-2-methoxycyclopentyl]-3-(2-methylpropyl)pyridin-2-one;2-[(3S)-3-methoxypyrrolidin-1-yl]-6-(2-methylpropyl)pyridine;N-methyl-4-(propan-2-ylamino)-1,2-thiazole-3-carboxamide?
The canonical SMILES for bis(5-chloro-2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);1-[(1S,2S)-2-methoxycyclobutyl]-3-(2-methylpropyl)pyridin-2-one;bis(2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);1-[(1R,2S)-2-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1S,3S)-3-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1R,3S)-3-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;bis(1-(4-methoxycyclohexyl)-3-(2-methylpropyl)pyridin-2-one);1-[(1S,2S)-2-methoxycyclopentyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1R,2S)-2-methoxycyclopentyl]-3-(2-methylpropyl)pyridin-2-one;2-[(3S)-3-methoxypyrrolidin-1-yl]-6-(2-methylpropyl)pyridine;N-methyl-4-(propan-2-ylamino)-1,2-thiazole-3-carboxamide is CNC(=O)c1nscc1NC(C)C.COC1CC(Oc2ncc(Cl)cc2NC(C)C)C1.COC1CC(Oc2ncc(Cl)cc2NC(C)C)C1.COC1CC(Oc2ncccc2NC(C)C)C1.COC1CC(Oc2ncccc2NC(C)C)C1.COC1CCC(n2cccc(CC(C)C)c2=O)CC1.COC1CCC(n2cccc(CC(C)C)c2=O)CC1.CO[C@H]1CCCC[C@H]1n1cccc(CC(C)C)c1=O.CO[C@H]1CCC[C@@H](n2cccc(CC(C)C)c2=O)C1.CO[C@H]1CCC[C@@H]1n1cccc(CC(C)C)c1=O.CO[C@H]1CCC[C@H](n2cccc(CC(C)C)c2=O)C1.CO[C@H]1CCC[C@H]1n1cccc(CC(C)C)c1=O.CO[C@H]1CCN(c2cccc(CC(C)C)n2)C1.CO[C@H]1CC[C@@H]1n1cccc(CC(C)C)c1=O.
What is the InChIKey of bis(5-chloro-2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);1-[(1S,2S)-2-methoxycyclobutyl]-3-(2-methylpropyl)pyridin-2-one;bis(2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);1-[(1R,2S)-2-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1S,3S)-3-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1R,3S)-3-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;bis(1-(4-methoxycyclohexyl)-3-(2-methylpropyl)pyridin-2-one);1-[(1S,2S)-2-methoxycyclopentyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1R,2S)-2-methoxycyclopentyl]-3-(2-methylpropyl)pyridin-2-one;2-[(3S)-3-methoxypyrrolidin-1-yl]-6-(2-methylpropyl)pyridine;N-methyl-4-(propan-2-ylamino)-1,2-thiazole-3-carboxamide?
The InChIKey is JZNFCOJOZVFRAA-RDBJOWFNSA-N. The full InChI is InChI=1S/5C16H25NO2.2C15H23NO2.C14H22N2O.C14H21NO2.2C13H19ClN2O2.2C13H20N2O2.C8H13N3OS/c2*1-12(2)10-13-6-5-9-17(16(13)18)14-7-4-8-15(11-14)19-3;2*1-12(2)11-13-5-4-10-17(16(13)18)14-6-8-15(19-3)9-7-14;1-12(2)11-13-7-6-10-17(16(13)18)14-8-4-5-9-15(14)19-3;2*1-11(2)10-12-6-5-9-16(15(12)17)13-7-4-8-14(13)18-3;1-11(2)9-12-5-4-6-14(15-12)16-8-7-13(10-16)17-3;1-10(2)9-11-5-4-8-15(14(11)16)12-6-7-13(12)17-3;2*1-8(2)16-12-4-9(14)7-15-13(12)18-11-5-10(6-11)17-3;2*1-9(2)15-12-5-4-6-14-13(12)17-11-7-10(8-11)16-3;1-5(2)10-6-4-13-11-7(6)8(12)9-3/h2*5-6,9,12,14-15H,4,7-8,10-11H2,1-3H3;2*4-5,10,12,14-15H,6-9,11H2,1-3H3;6-7,10,12,14-15H,4-5,8-9,11H2,1-3H3;2*5-6,9,11,13-14H,4,7-8,10H2,1-3H3;4-6,11,13H,7-10H2,1-3H3;4-5,8,10,12-13H,6-7,9H2,1-3H3;2*4,7-8,10-11,16H,5-6H2,1-3H3;2*4-6,9-11,15H,7-8H2,1-3H3;4-5,10H,1-3H3,(H,9,12)/t14-,15+;14-,15-;;;14-,15+;13-,14+;13-,14-;13-;12-,13-;;;;;/m10..11000...../s1.
What are the key properties of bis(5-chloro-2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);1-[(1S,2S)-2-methoxycyclobutyl]-3-(2-methylpropyl)pyridin-2-one;bis(2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);1-[(1R,2S)-2-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1S,3S)-3-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1R,3S)-3-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;bis(1-(4-methoxycyclohexyl)-3-(2-methylpropyl)pyridin-2-one);1-[(1S,2S)-2-methoxycyclopentyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1R,2S)-2-methoxycyclopentyl]-3-(2-methylpropyl)pyridin-2-one;2-[(3S)-3-methoxypyrrolidin-1-yl]-6-(2-methylpropyl)pyridine;N-methyl-4-(propan-2-ylamino)-1,2-thiazole-3-carboxamide?
bis(5-chloro-2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);1-[(1S,2S)-2-methoxycyclobutyl]-3-(2-methylpropyl)pyridin-2-one;bis(2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);1-[(1R,2S)-2-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1S,3S)-3-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1R,3S)-3-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;bis(1-(4-methoxycyclohexyl)-3-(2-methylpropyl)pyridin-2-one);1-[(1S,2S)-2-methoxycyclopentyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1R,2S)-2-methoxycyclopentyl]-3-(2-methylpropyl)pyridin-2-one;2-[(3S)-3-methoxypyrrolidin-1-yl]-6-(2-methylpropyl)pyridine;N-methyl-4-(propan-2-ylamino)-1,2-thiazole-3-carboxamide has a molecular weight of 3498.71 g/mol, XLogP of 38.82, 59 rotatable bonds, 6 hydrogen bond donors, and 47 hydrogen bond acceptors.
Where does this data come from?
All data for bis(5-chloro-2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);1-[(1S,2S)-2-methoxycyclobutyl]-3-(2-methylpropyl)pyridin-2-one;bis(2-(3-methoxycyclobutyl)oxy-N-propan-2-ylpyridin-3-amine);1-[(1R,2S)-2-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1S,3S)-3-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1R,3S)-3-methoxycyclohexyl]-3-(2-methylpropyl)pyridin-2-one;bis(1-(4-methoxycyclohexyl)-3-(2-methylpropyl)pyridin-2-one);1-[(1S,2S)-2-methoxycyclopentyl]-3-(2-methylpropyl)pyridin-2-one;1-[(1R,2S)-2-methoxycyclopentyl]-3-(2-methylpropyl)pyridin-2-one;2-[(3S)-3-methoxypyrrolidin-1-yl]-6-(2-methylpropyl)pyridine;N-methyl-4-(propan-2-ylamino)-1,2-thiazole-3-carboxamide is sourced from PubChem (CID 159069964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).