N-(azetidin-3-yl)-6-tert-butyl-2-(4-ethylpiperazin-1-yl)pyrimidin-4-amine;N-(azetidin-3-yl)-6-tert-butyl-2-propan-2-yloxypyrimidin-4-amine;6-tert-butyl-2-methoxy-N-(oxetan-3-yl)pyrimidin-4-amine;6-tert-butyl-2-(2-methylpropyl)-N-(oxetan-3-yl)pyrimidin-4-amine;1-[4-[4-tert-butyl-6-(oxetan-3-ylamino)pyrimidin-2-yl]piperazin-1-yl]-2-methylpropan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]butan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]-3-methylbutan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]-2-methylpropan-1-one;methane

C140H250N30O9 — CID 159913103

IUPACN-(azetidin-3-yl)-6-tert-butyl-2-(4-ethylpiperazin-1-yl)pyrimidin-4-amine;N-(azetidin-3-yl)-6-tert-butyl-2-propan-2-yloxypyrimidin-4-amine;6-tert-butyl-2-methoxy-N-(oxetan-3-yl)pyrimidin-4-amine;6-tert-butyl-2-(2-methylpropyl)-N-(oxetan-3-yl)pyrimidin-4-amine;1-[4-[4-tert-butyl-6-(oxetan-3-ylamino)pyrimidin-2-yl]piperazin-1-yl]-2-methylpropan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]butan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]-3-methylbutan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]-2-methylpropan-1-one;methane
SMILESC.C.C.C.C.C.C.C.CC(C)C(=O)N1CCC(Nc2cc(C(C)(C)C)ccn2)CC1.CC(C)C(=O)N1CCN(c2nc(NC3COC3)cc(C(C)(C)C)n2)CC1.CC(C)CC(=O)N1CCC(Nc2cc(C(C)(C)C)ccn2)CC1.CC(C)Cc1nc(NC2COC2)cc(C(C)(C)C)n1.CC(C)Oc1nc(NC2CNC2)cc(C(C)(C)C)n1.CCCC(=O)N1CCC(Nc2cc(C(C)(C)C)ccn2)CC1.CCN1CCN(c2nc(NC3CNC3)cc(C(C)(C)C)n2)CC1.COc1nc(NC2COC2)cc(C(C)(C)C)n1
InChIInChI=1S/C19H31N5O2.C19H31N3O.2C18H29N3O.C17H30N6.C15H25N3O.C14H24N4O.C12H19N3O2.8CH4/c1-13(2)17(25)23-6-8-24(9-7-23)18-21-15(19(3,4)5)10-16(22-18)20-14-11-26-12-14;1-14(2)12-18(23)22-10-7-16(8-11-22)21-17-13-15(6-9-20-17)19(3,4)5;1-13(2)17(22)21-10-7-15(8-11-21)20-16-12-14(6-9-19-16)18(3,4)5;1-5-6-17(22)21-11-8-15(9-12-21)20-16-13-14(7-10-19-16)18(2,3)4;1-5-22-6-8-23(9-7-22)16-20-14(17(2,3)4)10-15(21-16)19-13-11-18-12-13;1-10(2)6-13-17-12(15(3,4)5)7-14(18-13)16-11-8-19-9-11;1-9(2)19-13-17-11(14(3,4)5)6-12(18-13)16-10-7-15-8-10;1-12(2,3)9-5-10(13-8-6-17-7-8)15-11(14-9)16-4;;;;;;;;/h10,13-14H,6-9,11-12H2,1-5H3,(H,20,21,22);6,9,13-14,16H,7-8,10-12H2,1-5H3,(H,20,21);6,9,12-13,15H,7-8,10-11H2,1-5H3,(H,19,20);7,10,13,15H,5-6,8-9,11-12H2,1-4H3,(H,19,20);10,13,18H,5-9,11-12H2,1-4H3,(H,19,20,21);7,10-11H,6,8-9H2,1-5H3,(H,16,17,18);6,9-10,15H,7-8H2,1-5H3,(H,16,17,18);5,8H,6-7H2,1-4H3,(H,13,14,15);8*1H4
InChIKeyNXKVRILEUPYANH-UHFFFAOYSA-N
MW2497.74 g/mol
LogP25.45
Rot. Bonds30

About N-(azetidin-3-yl)-6-tert-butyl-2-(4-ethylpiperazin-1-yl)pyrimidin-4-amine;N-(azetidin-3-yl)-6-tert-butyl-2-propan-2-yloxypyrimidin-4-amine;6-tert-butyl-2-methoxy-N-(oxetan-3-yl)pyrimidin-4-amine;6-tert-butyl-2-(2-methylpropyl)-N-(oxetan-3-yl)pyrimidin-4-amine;1-[4-[4-tert-butyl-6-(oxetan-3-ylamino)pyrimidin-2-yl]piperazin-1-yl]-2-methylpropan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]butan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]-3-methylbutan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]-2-methylpropan-1-one;methane

N-(azetidin-3-yl)-6-tert-butyl-2-(4-ethylpiperazin-1-yl)pyrimidin-4-amine;N-(azetidin-3-yl)-6-tert-butyl-2-propan-2-yloxypyrimidin-4-amine;6-tert-butyl-2-methoxy-N-(oxetan-3-yl)pyrimidin-4-amine;6-tert-butyl-2-(2-methylpropyl)-N-(oxetan-3-yl)pyrimidin-4-amine;1-[4-[4-tert-butyl-6-(oxetan-3-ylamino)pyrimidin-2-yl]piperazin-1-yl]-2-methylpropan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]butan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]-3-methylbutan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]-2-methylpropan-1-one;methane (PubChem CID 159913103) has the molecular formula C140H250N30O9 and a molecular weight of 2497.74 g/mol. Its IUPAC name is N-(azetidin-3-yl)-6-tert-butyl-2-(4-ethylpiperazin-1-yl)pyrimidin-4-amine;N-(azetidin-3-yl)-6-tert-butyl-2-propan-2-yloxypyrimidin-4-amine;6-tert-butyl-2-methoxy-N-(oxetan-3-yl)pyrimidin-4-amine;6-tert-butyl-2-(2-methylpropyl)-N-(oxetan-3-yl)pyrimidin-4-amine;1-[4-[4-tert-butyl-6-(oxetan-3-ylamino)pyrimidin-2-yl]piperazin-1-yl]-2-methylpropan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]butan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]-3-methylbutan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]-2-methylpropan-1-one;methane.

Molecular Properties

Compound NameN-(azetidin-3-yl)-6-tert-butyl-2-(4-ethylpiperazin-1-yl)pyrimidin-4-amine;N-(azetidin-3-yl)-6-tert-butyl-2-propan-2-yloxypyrimidin-4-amine;6-tert-butyl-2-methoxy-N-(oxetan-3-yl)pyrimidin-4-amine;6-tert-butyl-2-(2-methylpropyl)-N-(oxetan-3-yl)pyrimidin-4-amine;1-[4-[4-tert-butyl-6-(oxetan-3-ylamino)pyrimidin-2-yl]piperazin-1-yl]-2-methylpropan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]butan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]-3-methylbutan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]-2-methylpropan-1-one;methane
PubChem CID159913103
Molecular FormulaC140H250N30O9
Molecular Weight2497.74 g/mol
Exact Mass2496.00
IUPAC NameN-(azetidin-3-yl)-6-tert-butyl-2-(4-ethylpiperazin-1-yl)pyrimidin-4-amine;N-(azetidin-3-yl)-6-tert-butyl-2-propan-2-yloxypyrimidin-4-amine;6-tert-butyl-2-methoxy-N-(oxetan-3-yl)pyrimidin-4-amine;6-tert-butyl-2-(2-methylpropyl)-N-(oxetan-3-yl)pyrimidin-4-amine;1-[4-[4-tert-butyl-6-(oxetan-3-ylamino)pyrimidin-2-yl]piperazin-1-yl]-2-methylpropan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]butan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]-3-methylbutan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]-2-methylpropan-1-one;methane
SMILESC.C.C.C.C.C.C.C.CC(C)C(=O)N1CCC(Nc2cc(C(C)(C)C)ccn2)CC1.CC(C)C(=O)N1CCN(c2nc(NC3COC3)cc(C(C)(C)C)n2)CC1.CC(C)CC(=O)N1CCC(Nc2cc(C(C)(C)C)ccn2)CC1.CC(C)Cc1nc(NC2COC2)cc(C(C)(C)C)n1.CC(C)Oc1nc(NC2CNC2)cc(C(C)(C)C)n1.CCCC(=O)N1CCC(Nc2cc(C(C)(C)C)ccn2)CC1.CCN1CCN(c2nc(NC3CNC3)cc(C(C)(C)C)n2)CC1.COc1nc(NC2COC2)cc(C(C)(C)C)n1
InChIInChI=1S/C19H31N5O2.C19H31N3O.2C18H29N3O.C17H30N6.C15H25N3O.C14H24N4O.C12H19N3O2.8CH4/c1-13(2)17(25)23-6-8-24(9-7-23)18-21-15(19(3,4)5)10-16(22-18)20-14-11-26-12-14;1-14(2)12-18(23)22-10-7-16(8-11-22)21-17-13-15(6-9-20-17)19(3,4)5;1-13(2)17(22)21-10-7-15(8-11-21)20-16-12-14(6-9-19-16)18(3,4)5;1-5-6-17(22)21-11-8-15(9-12-21)20-16-13-14(7-10-19-16)18(2,3)4;1-5-22-6-8-23(9-7-22)16-20-14(17(2,3)4)10-15(21-16)19-13-11-18-12-13;1-10(2)6-13-17-12(15(3,4)5)7-14(18-13)16-11-8-19-9-11;1-9(2)19-13-17-11(14(3,4)5)6-12(18-13)16-10-7-15-8-10;1-12(2,3)9-5-10(13-8-6-17-7-8)15-11(14-9)16-4;;;;;;;;/h10,13-14H,6-9,11-12H2,1-5H3,(H,20,21,22);6,9,13-14,16H,7-8,10-12H2,1-5H3,(H,20,21);6,9,12-13,15H,7-8,10-11H2,1-5H3,(H,19,20);7,10,13,15H,5-6,8-9,11-12H2,1-4H3,(H,19,20);10,13,18H,5-9,11-12H2,1-4H3,(H,19,20,21);7,10-11H,6,8-9H2,1-5H3,(H,16,17,18);6,9-10,15H,7-8H2,1-5H3,(H,16,17,18);5,8H,6-7H2,1-4H3,(H,13,14,15);8*1H4
InChIKeyNXKVRILEUPYANH-UHFFFAOYSA-N
XLogP25.45
TPSA424.98 Ų
H-Bond Donors10
H-Bond Acceptors35
Rotatable Bonds30
Heavy Atoms179
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002497.74
LogP ≤ 525.45
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1035

Analyze N-(azetidin-3-yl)-6-tert-butyl-2-(4-ethylpiperazin-1-yl)pyrimidin-4-amine;N-(azetidin-3-yl)-6-tert-butyl-2-propan-2-yloxypyrimidin-4-amine;6-tert-butyl-2-methoxy-N-(oxetan-3-yl)pyrimidin-4-amine;6-tert-butyl-2-(2-methylpropyl)-N-(oxetan-3-yl)pyrimidin-4-amine;1-[4-[4-tert-butyl-6-(oxetan-3-ylamino)pyrimidin-2-yl]piperazin-1-yl]-2-methylpropan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]butan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]-3-methylbutan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]-2-methylpropan-1-one;methane 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

4-tert-butyl-N-cyclobutyl-6-(4-methylpiperazin-1-yl)pyridin-2-amine;4-tert-butyl-2-[2-(1-methylpiperidin-2-yl)ethyl]pyridine;6-tert-butyl-N-(oxetan-3-yl)-2-piperidin-1-ylpyrimidin-4-amine;4-tert-butyl-2-(pyridin-4-ylmethyl)pyridine;1-[3-[(6-tert-butylpyrimidin-4-yl)methyl]azetidin-1-yl]butan-1-one;1-[3-[(6-tert-butylpyrimidin-4-yl)methyl]azetidin-1-yl]-2-methylpropan-1-one;1-[4-[(6-tert-butylpyrimidin-4-yl)methyl]piperidin-1-yl]-2,2-dimethylpropan-1-one;1-[4-[(6-tert-butylpyrimidin-4-yl)methyl]piperidin-1-yl]-3-methylbutan-1-one
CID 158835705
1-[4-[4-tert-butyl-6-(oxetan-3-ylamino)pyrimidin-2-yl]piperazin-1-yl]propan-1-one
CID 118546942
6-tert-butyl-2-(4-tert-butylpiperazin-1-yl)-N-(oxetan-3-yl)pyrimidin-4-amine;6-tert-butyl-2-(4-ethylpiperazin-1-yl)-N-(oxetan-3-yl)pyrimidin-4-amine;6-tert-butyl-N-(oxetan-3-yl)-2-(4-propan-2-ylpiperazin-1-yl)pyrimidin-4-amine;[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]-cyclopropylmethanone;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]-2,2-dimethylpropan-1-one;1-[3-(6-tert-butylpyrimidin-4-yl)oxyazetidin-1-yl]ethanone
CID 162017612
methyl 2-[4-(2-methylpropanoyl)piperazin-1-yl]-6-(oxetan-3-ylamino)pyrimidine-4-carboxylate
CID 162458199
1-[4-[(4-ethyl-2-pyridinyl)amino]piperidin-1-yl]-3-methylbutan-1-one;molecular hydrogen
CID 144655303
N-(azetidin-3-yl)-6-tert-butyl-2-piperazin-1-ylpyrimidin-4-amine
CID 118546939
N-(azetidin-3-yl)-2-(4-ethylpiperazin-1-yl)pyrimidin-4-amine
CID 144655908
1-[4-[4-(oxetan-3-ylamino)pyrimidin-2-yl]piperazin-1-yl]propan-1-one
CID 144655538
2-(4-ethylpiperazin-1-yl)-6-methyl-N-(oxetan-3-yl)pyrimidin-4-amine
CID 118549633
1-(2-methoxypyrimidin-4-yl)-3-[1-(3-methylbutanoyl)piperidin-4-yl]urea
CID 136540973
1-[4-[4-methyl-6-(oxetan-3-ylamino)pyrimidin-2-yl]piperazin-1-yl]propan-1-one
CID 118549624
6-tert-butyl-N-cyclobutyl-2-(4-propan-2-ylpiperazin-1-yl)pyrimidin-4-amine
CID 130260837

Frequently Asked Questions

What is the IUPAC name of N-(azetidin-3-yl)-6-tert-butyl-2-(4-ethylpiperazin-1-yl)pyrimidin-4-amine;N-(azetidin-3-yl)-6-tert-butyl-2-propan-2-yloxypyrimidin-4-amine;6-tert-butyl-2-methoxy-N-(oxetan-3-yl)pyrimidin-4-amine;6-tert-butyl-2-(2-methylpropyl)-N-(oxetan-3-yl)pyrimidin-4-amine;1-[4-[4-tert-butyl-6-(oxetan-3-ylamino)pyrimidin-2-yl]piperazin-1-yl]-2-methylpropan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]butan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]-3-methylbutan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]-2-methylpropan-1-one;methane?
The IUPAC name of N-(azetidin-3-yl)-6-tert-butyl-2-(4-ethylpiperazin-1-yl)pyrimidin-4-amine;N-(azetidin-3-yl)-6-tert-butyl-2-propan-2-yloxypyrimidin-4-amine;6-tert-butyl-2-methoxy-N-(oxetan-3-yl)pyrimidin-4-amine;6-tert-butyl-2-(2-methylpropyl)-N-(oxetan-3-yl)pyrimidin-4-amine;1-[4-[4-tert-butyl-6-(oxetan-3-ylamino)pyrimidin-2-yl]piperazin-1-yl]-2-methylpropan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]butan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]-3-methylbutan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]-2-methylpropan-1-one;methane (CID 159913103) is N-(azetidin-3-yl)-6-tert-butyl-2-(4-ethylpiperazin-1-yl)pyrimidin-4-amine;N-(azetidin-3-yl)-6-tert-butyl-2-propan-2-yloxypyrimidin-4-amine;6-tert-butyl-2-methoxy-N-(oxetan-3-yl)pyrimidin-4-amine;6-tert-butyl-2-(2-methylpropyl)-N-(oxetan-3-yl)pyrimidin-4-amine;1-[4-[4-tert-butyl-6-(oxetan-3-ylamino)pyrimidin-2-yl]piperazin-1-yl]-2-methylpropan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]butan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]-3-methylbutan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]-2-methylpropan-1-one;methane.
What is the SMILES notation for N-(azetidin-3-yl)-6-tert-butyl-2-(4-ethylpiperazin-1-yl)pyrimidin-4-amine;N-(azetidin-3-yl)-6-tert-butyl-2-propan-2-yloxypyrimidin-4-amine;6-tert-butyl-2-methoxy-N-(oxetan-3-yl)pyrimidin-4-amine;6-tert-butyl-2-(2-methylpropyl)-N-(oxetan-3-yl)pyrimidin-4-amine;1-[4-[4-tert-butyl-6-(oxetan-3-ylamino)pyrimidin-2-yl]piperazin-1-yl]-2-methylpropan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]butan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]-3-methylbutan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]-2-methylpropan-1-one;methane?
The canonical SMILES for N-(azetidin-3-yl)-6-tert-butyl-2-(4-ethylpiperazin-1-yl)pyrimidin-4-amine;N-(azetidin-3-yl)-6-tert-butyl-2-propan-2-yloxypyrimidin-4-amine;6-tert-butyl-2-methoxy-N-(oxetan-3-yl)pyrimidin-4-amine;6-tert-butyl-2-(2-methylpropyl)-N-(oxetan-3-yl)pyrimidin-4-amine;1-[4-[4-tert-butyl-6-(oxetan-3-ylamino)pyrimidin-2-yl]piperazin-1-yl]-2-methylpropan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]butan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]-3-methylbutan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]-2-methylpropan-1-one;methane is C.C.C.C.C.C.C.C.CC(C)C(=O)N1CCC(Nc2cc(C(C)(C)C)ccn2)CC1.CC(C)C(=O)N1CCN(c2nc(NC3COC3)cc(C(C)(C)C)n2)CC1.CC(C)CC(=O)N1CCC(Nc2cc(C(C)(C)C)ccn2)CC1.CC(C)Cc1nc(NC2COC2)cc(C(C)(C)C)n1.CC(C)Oc1nc(NC2CNC2)cc(C(C)(C)C)n1.CCCC(=O)N1CCC(Nc2cc(C(C)(C)C)ccn2)CC1.CCN1CCN(c2nc(NC3CNC3)cc(C(C)(C)C)n2)CC1.COc1nc(NC2COC2)cc(C(C)(C)C)n1.
What is the InChIKey of N-(azetidin-3-yl)-6-tert-butyl-2-(4-ethylpiperazin-1-yl)pyrimidin-4-amine;N-(azetidin-3-yl)-6-tert-butyl-2-propan-2-yloxypyrimidin-4-amine;6-tert-butyl-2-methoxy-N-(oxetan-3-yl)pyrimidin-4-amine;6-tert-butyl-2-(2-methylpropyl)-N-(oxetan-3-yl)pyrimidin-4-amine;1-[4-[4-tert-butyl-6-(oxetan-3-ylamino)pyrimidin-2-yl]piperazin-1-yl]-2-methylpropan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]butan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]-3-methylbutan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]-2-methylpropan-1-one;methane?
The InChIKey is NXKVRILEUPYANH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H31N5O2.C19H31N3O.2C18H29N3O.C17H30N6.C15H25N3O.C14H24N4O.C12H19N3O2.8CH4/c1-13(2)17(25)23-6-8-24(9-7-23)18-21-15(19(3,4)5)10-16(22-18)20-14-11-26-12-14;1-14(2)12-18(23)22-10-7-16(8-11-22)21-17-13-15(6-9-20-17)19(3,4)5;1-13(2)17(22)21-10-7-15(8-11-21)20-16-12-14(6-9-19-16)18(3,4)5;1-5-6-17(22)21-11-8-15(9-12-21)20-16-13-14(7-10-19-16)18(2,3)4;1-5-22-6-8-23(9-7-22)16-20-14(17(2,3)4)10-15(21-16)19-13-11-18-12-13;1-10(2)6-13-17-12(15(3,4)5)7-14(18-13)16-11-8-19-9-11;1-9(2)19-13-17-11(14(3,4)5)6-12(18-13)16-10-7-15-8-10;1-12(2,3)9-5-10(13-8-6-17-7-8)15-11(14-9)16-4;;;;;;;;/h10,13-14H,6-9,11-12H2,1-5H3,(H,20,21,22);6,9,13-14,16H,7-8,10-12H2,1-5H3,(H,20,21);6,9,12-13,15H,7-8,10-11H2,1-5H3,(H,19,20);7,10,13,15H,5-6,8-9,11-12H2,1-4H3,(H,19,20);10,13,18H,5-9,11-12H2,1-4H3,(H,19,20,21);7,10-11H,6,8-9H2,1-5H3,(H,16,17,18);6,9-10,15H,7-8H2,1-5H3,(H,16,17,18);5,8H,6-7H2,1-4H3,(H,13,14,15);8*1H4.
What are the key properties of N-(azetidin-3-yl)-6-tert-butyl-2-(4-ethylpiperazin-1-yl)pyrimidin-4-amine;N-(azetidin-3-yl)-6-tert-butyl-2-propan-2-yloxypyrimidin-4-amine;6-tert-butyl-2-methoxy-N-(oxetan-3-yl)pyrimidin-4-amine;6-tert-butyl-2-(2-methylpropyl)-N-(oxetan-3-yl)pyrimidin-4-amine;1-[4-[4-tert-butyl-6-(oxetan-3-ylamino)pyrimidin-2-yl]piperazin-1-yl]-2-methylpropan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]butan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]-3-methylbutan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]-2-methylpropan-1-one;methane?
N-(azetidin-3-yl)-6-tert-butyl-2-(4-ethylpiperazin-1-yl)pyrimidin-4-amine;N-(azetidin-3-yl)-6-tert-butyl-2-propan-2-yloxypyrimidin-4-amine;6-tert-butyl-2-methoxy-N-(oxetan-3-yl)pyrimidin-4-amine;6-tert-butyl-2-(2-methylpropyl)-N-(oxetan-3-yl)pyrimidin-4-amine;1-[4-[4-tert-butyl-6-(oxetan-3-ylamino)pyrimidin-2-yl]piperazin-1-yl]-2-methylpropan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]butan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]-3-methylbutan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]-2-methylpropan-1-one;methane has a molecular weight of 2497.74 g/mol, XLogP of 25.45, 30 rotatable bonds, 10 hydrogen bond donors, and 35 hydrogen bond acceptors.
Where does this data come from?
All data for N-(azetidin-3-yl)-6-tert-butyl-2-(4-ethylpiperazin-1-yl)pyrimidin-4-amine;N-(azetidin-3-yl)-6-tert-butyl-2-propan-2-yloxypyrimidin-4-amine;6-tert-butyl-2-methoxy-N-(oxetan-3-yl)pyrimidin-4-amine;6-tert-butyl-2-(2-methylpropyl)-N-(oxetan-3-yl)pyrimidin-4-amine;1-[4-[4-tert-butyl-6-(oxetan-3-ylamino)pyrimidin-2-yl]piperazin-1-yl]-2-methylpropan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]butan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]-3-methylbutan-1-one;1-[4-[(4-tert-butyl-2-pyridinyl)amino]piperidin-1-yl]-2-methylpropan-1-one;methane is sourced from PubChem (CID 159913103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).