5-(tert-butylamino)-1-phenylpyridin-2-one;4-(tert-butylamino)-2-(1,3-thiazol-5-yl)phenol;5-(tert-butylamino)-3-(1,3-thiazol-5-yl)-1H-pyridin-2-one;N-tert-butyl-3-chloro-5-(1,3-thiazol-5-yl)aniline;N-tert-butyl-3-[3-[2-(dimethylamino)ethyl]imidazol-4-yl]aniline;N-tert-butyl-3-(1H-imidazol-2-yl)aniline;N-tert-butyl-1H-indol-4-amine;N-tert-butyl-4-methoxy-3-(1H-pyrrol-2-yl)aniline;N-tert-butyl-4-methoxy-3-(1,3-thiazol-5-yl)aniline;N-tert-butyl-4-methoxy-3-thiophen-3-ylaniline;N-tert-butyl-3-(4-methyl-1,2,4-triazol-3-yl)aniline;N-tert-butylnaphthalen-1-amine;N-tert-butyl-3-(1H-pyrazol-4-yl)aniline;N-tert-butyl-3-(1H-pyrrol-2-yl)aniline;N-tert-butyl-3-thiophen-3-ylaniline

C207H267ClN34O6S6 — CID 158194156

IUPAC5-(tert-butylamino)-1-phenylpyridin-2-one;4-(tert-butylamino)-2-(1,3-thiazol-5-yl)phenol;5-(tert-butylamino)-3-(1,3-thiazol-5-yl)-1H-pyridin-2-one;N-tert-butyl-3-chloro-5-(1,3-thiazol-5-yl)aniline;N-tert-butyl-3-[3-[2-(dimethylamino)ethyl]imidazol-4-yl]aniline;N-tert-butyl-3-(1H-imidazol-2-yl)aniline;N-tert-butyl-1H-indol-4-amine;N-tert-butyl-4-methoxy-3-(1H-pyrrol-2-yl)aniline;N-tert-butyl-4-methoxy-3-(1,3-thiazol-5-yl)aniline;N-tert-butyl-4-methoxy-3-thiophen-3-ylaniline;N-tert-butyl-3-(4-methyl-1,2,4-triazol-3-yl)aniline;N-tert-butylnaphthalen-1-amine;N-tert-butyl-3-(1H-pyrazol-4-yl)aniline;N-tert-butyl-3-(1H-pyrrol-2-yl)aniline;N-tert-butyl-3-thiophen-3-ylaniline
SMILESCC(C)(C)Nc1c[nH]c(=O)c(-c2cncs2)c1.CC(C)(C)Nc1cc(Cl)cc(-c2cncs2)c1.CC(C)(C)Nc1ccc(=O)n(-c2ccccc2)c1.CC(C)(C)Nc1ccc(O)c(-c2cncs2)c1.CC(C)(C)Nc1cccc(-c2ccc[nH]2)c1.CC(C)(C)Nc1cccc(-c2ccsc2)c1.CC(C)(C)Nc1cccc(-c2cn[nH]c2)c1.CC(C)(C)Nc1cccc(-c2ncc[nH]2)c1.CC(C)(C)Nc1cccc2[nH]ccc12.CC(C)(C)Nc1cccc2ccccc12.CN(C)CCn1cncc1-c1cccc(NC(C)(C)C)c1.COc1ccc(NC(C)(C)C)cc1-c1ccc[nH]1.COc1ccc(NC(C)(C)C)cc1-c1ccsc1.COc1ccc(NC(C)(C)C)cc1-c1cncs1.Cn1cnnc1-c1cccc(NC(C)(C)C)c1
InChIInChI=1S/C17H26N4.C15H20N2O.C15H18N2O.C15H19NOS.C14H18N2OS.C14H18N2.C14H17NS.C14H17N.C13H15ClN2S.C13H18N4.2C13H17N3.C13H16N2OS.C12H15N3OS.C12H16N2/c1-17(2,3)19-15-8-6-7-14(11-15)16-12-18-13-21(16)10-9-20(4)5;1-15(2,3)17-11-7-8-14(18-4)12(10-11)13-6-5-9-16-13;1-15(2,3)16-12-9-10-14(18)17(11-12)13-7-5-4-6-8-13;1-15(2,3)16-12-5-6-14(17-4)13(9-12)11-7-8-18-10-11;1-14(2,3)16-10-5-6-12(17-4)11(7-10)13-8-15-9-18-13;1-14(2,3)16-12-7-4-6-11(10-12)13-8-5-9-15-13;1-14(2,3)15-13-6-4-5-11(9-13)12-7-8-16-10-12;1-14(2,3)15-13-10-6-8-11-7-4-5-9-12(11)13;1-13(2,3)16-11-5-9(4-10(14)6-11)12-7-15-8-17-12;1-13(2,3)15-11-7-5-6-10(8-11)12-16-14-9-17(12)4;1-13(2,3)16-12-6-4-5-10(7-12)11-8-14-15-9-11;1-13(2,3)16-11-6-4-5-10(9-11)12-14-7-8-15-12;1-13(2,3)15-9-4-5-11(16)10(6-9)12-7-14-8-17-12;1-12(2,3)15-8-4-9(11(16)14-5-8)10-6-13-7-17-10;1-12(2,3)14-11-6-4-5-10-9(11)7-8-13-10/h6-8,11-13,19H,9-10H2,1-5H3;5-10,16-17H,1-4H3;4-11,16H,1-3H3;5-10,16H,1-4H3;5-9,16H,1-4H3;4-10,15-16H,1-3H3;4-10,15H,1-3H3;4-10,15H,1-3H3;4-8,16H,1-3H3;5-9,15H,1-4H3;2*4-9,16H,1-3H3,(H,14,15);4-8,15-16H,1-3H3;4-7,15H,1-3H3,(H,14,16);4-8,13-14H,1-3H3
InChIKeyGADDRMFTTUUYEV-UHFFFAOYSA-N
MW3555.50 g/mol
LogP55.26
Rot. Bonds34

About 5-(tert-butylamino)-1-phenylpyridin-2-one;4-(tert-butylamino)-2-(1,3-thiazol-5-yl)phenol;5-(tert-butylamino)-3-(1,3-thiazol-5-yl)-1H-pyridin-2-one;N-tert-butyl-3-chloro-5-(1,3-thiazol-5-yl)aniline;N-tert-butyl-3-[3-[2-(dimethylamino)ethyl]imidazol-4-yl]aniline;N-tert-butyl-3-(1H-imidazol-2-yl)aniline;N-tert-butyl-1H-indol-4-amine;N-tert-butyl-4-methoxy-3-(1H-pyrrol-2-yl)aniline;N-tert-butyl-4-methoxy-3-(1,3-thiazol-5-yl)aniline;N-tert-butyl-4-methoxy-3-thiophen-3-ylaniline;N-tert-butyl-3-(4-methyl-1,2,4-triazol-3-yl)aniline;N-tert-butylnaphthalen-1-amine;N-tert-butyl-3-(1H-pyrazol-4-yl)aniline;N-tert-butyl-3-(1H-pyrrol-2-yl)aniline;N-tert-butyl-3-thiophen-3-ylaniline

5-(tert-butylamino)-1-phenylpyridin-2-one;4-(tert-butylamino)-2-(1,3-thiazol-5-yl)phenol;5-(tert-butylamino)-3-(1,3-thiazol-5-yl)-1H-pyridin-2-one;N-tert-butyl-3-chloro-5-(1,3-thiazol-5-yl)aniline;N-tert-butyl-3-[3-[2-(dimethylamino)ethyl]imidazol-4-yl]aniline;N-tert-butyl-3-(1H-imidazol-2-yl)aniline;N-tert-butyl-1H-indol-4-amine;N-tert-butyl-4-methoxy-3-(1H-pyrrol-2-yl)aniline;N-tert-butyl-4-methoxy-3-(1,3-thiazol-5-yl)aniline;N-tert-butyl-4-methoxy-3-thiophen-3-ylaniline;N-tert-butyl-3-(4-methyl-1,2,4-triazol-3-yl)aniline;N-tert-butylnaphthalen-1-amine;N-tert-butyl-3-(1H-pyrazol-4-yl)aniline;N-tert-butyl-3-(1H-pyrrol-2-yl)aniline;N-tert-butyl-3-thiophen-3-ylaniline (PubChem CID 158194156) has the molecular formula C207H267ClN34O6S6 and a molecular weight of 3555.50 g/mol. Its IUPAC name is 5-(tert-butylamino)-1-phenylpyridin-2-one;4-(tert-butylamino)-2-(1,3-thiazol-5-yl)phenol;5-(tert-butylamino)-3-(1,3-thiazol-5-yl)-1H-pyridin-2-one;N-tert-butyl-3-chloro-5-(1,3-thiazol-5-yl)aniline;N-tert-butyl-3-[3-[2-(dimethylamino)ethyl]imidazol-4-yl]aniline;N-tert-butyl-3-(1H-imidazol-2-yl)aniline;N-tert-butyl-1H-indol-4-amine;N-tert-butyl-4-methoxy-3-(1H-pyrrol-2-yl)aniline;N-tert-butyl-4-methoxy-3-(1,3-thiazol-5-yl)aniline;N-tert-butyl-4-methoxy-3-thiophen-3-ylaniline;N-tert-butyl-3-(4-methyl-1,2,4-triazol-3-yl)aniline;N-tert-butylnaphthalen-1-amine;N-tert-butyl-3-(1H-pyrazol-4-yl)aniline;N-tert-butyl-3-(1H-pyrrol-2-yl)aniline;N-tert-butyl-3-thiophen-3-ylaniline.

Molecular Properties

Compound Name5-(tert-butylamino)-1-phenylpyridin-2-one;4-(tert-butylamino)-2-(1,3-thiazol-5-yl)phenol;5-(tert-butylamino)-3-(1,3-thiazol-5-yl)-1H-pyridin-2-one;N-tert-butyl-3-chloro-5-(1,3-thiazol-5-yl)aniline;N-tert-butyl-3-[3-[2-(dimethylamino)ethyl]imidazol-4-yl]aniline;N-tert-butyl-3-(1H-imidazol-2-yl)aniline;N-tert-butyl-1H-indol-4-amine;N-tert-butyl-4-methoxy-3-(1H-pyrrol-2-yl)aniline;N-tert-butyl-4-methoxy-3-(1,3-thiazol-5-yl)aniline;N-tert-butyl-4-methoxy-3-thiophen-3-ylaniline;N-tert-butyl-3-(4-methyl-1,2,4-triazol-3-yl)aniline;N-tert-butylnaphthalen-1-amine;N-tert-butyl-3-(1H-pyrazol-4-yl)aniline;N-tert-butyl-3-(1H-pyrrol-2-yl)aniline;N-tert-butyl-3-thiophen-3-ylaniline
PubChem CID158194156
Molecular FormulaC207H267ClN34O6S6
Molecular Weight3555.50 g/mol
Exact Mass3551.96
IUPAC Name5-(tert-butylamino)-1-phenylpyridin-2-one;4-(tert-butylamino)-2-(1,3-thiazol-5-yl)phenol;5-(tert-butylamino)-3-(1,3-thiazol-5-yl)-1H-pyridin-2-one;N-tert-butyl-3-chloro-5-(1,3-thiazol-5-yl)aniline;N-tert-butyl-3-[3-[2-(dimethylamino)ethyl]imidazol-4-yl]aniline;N-tert-butyl-3-(1H-imidazol-2-yl)aniline;N-tert-butyl-1H-indol-4-amine;N-tert-butyl-4-methoxy-3-(1H-pyrrol-2-yl)aniline;N-tert-butyl-4-methoxy-3-(1,3-thiazol-5-yl)aniline;N-tert-butyl-4-methoxy-3-thiophen-3-ylaniline;N-tert-butyl-3-(4-methyl-1,2,4-triazol-3-yl)aniline;N-tert-butylnaphthalen-1-amine;N-tert-butyl-3-(1H-pyrazol-4-yl)aniline;N-tert-butyl-3-(1H-pyrrol-2-yl)aniline;N-tert-butyl-3-thiophen-3-ylaniline
SMILESCC(C)(C)Nc1c[nH]c(=O)c(-c2cncs2)c1.CC(C)(C)Nc1cc(Cl)cc(-c2cncs2)c1.CC(C)(C)Nc1ccc(=O)n(-c2ccccc2)c1.CC(C)(C)Nc1ccc(O)c(-c2cncs2)c1.CC(C)(C)Nc1cccc(-c2ccc[nH]2)c1.CC(C)(C)Nc1cccc(-c2ccsc2)c1.CC(C)(C)Nc1cccc(-c2cn[nH]c2)c1.CC(C)(C)Nc1cccc(-c2ncc[nH]2)c1.CC(C)(C)Nc1cccc2[nH]ccc12.CC(C)(C)Nc1cccc2ccccc12.CN(C)CCn1cncc1-c1cccc(NC(C)(C)C)c1.COc1ccc(NC(C)(C)C)cc1-c1ccc[nH]1.COc1ccc(NC(C)(C)C)cc1-c1ccsc1.COc1ccc(NC(C)(C)C)cc1-c1cncs1.Cn1cnnc1-c1cccc(NC(C)(C)C)c1
InChIInChI=1S/C17H26N4.C15H20N2O.C15H18N2O.C15H19NOS.C14H18N2OS.C14H18N2.C14H17NS.C14H17N.C13H15ClN2S.C13H18N4.2C13H17N3.C13H16N2OS.C12H15N3OS.C12H16N2/c1-17(2,3)19-15-8-6-7-14(11-15)16-12-18-13-21(16)10-9-20(4)5;1-15(2,3)17-11-7-8-14(18-4)12(10-11)13-6-5-9-16-13;1-15(2,3)16-12-9-10-14(18)17(11-12)13-7-5-4-6-8-13;1-15(2,3)16-12-5-6-14(17-4)13(9-12)11-7-8-18-10-11;1-14(2,3)16-10-5-6-12(17-4)11(7-10)13-8-15-9-18-13;1-14(2,3)16-12-7-4-6-11(10-12)13-8-5-9-15-13;1-14(2,3)15-13-6-4-5-11(9-13)12-7-8-16-10-12;1-14(2,3)15-13-10-6-8-11-7-4-5-9-12(11)13;1-13(2,3)16-11-5-9(4-10(14)6-11)12-7-15-8-17-12;1-13(2,3)15-11-7-5-6-10(8-11)12-16-14-9-17(12)4;1-13(2,3)16-12-6-4-5-10(7-12)11-8-14-15-9-11;1-13(2,3)16-11-6-4-5-10(9-11)12-14-7-8-15-12;1-13(2,3)15-9-4-5-11(16)10(6-9)12-7-14-8-17-12;1-12(2,3)15-8-4-9(11(16)14-5-8)10-6-13-7-17-10;1-12(2,3)14-11-6-4-5-10-9(11)7-8-13-10/h6-8,11-13,19H,9-10H2,1-5H3;5-10,16-17H,1-4H3;4-11,16H,1-3H3;5-10,16H,1-4H3;5-9,16H,1-4H3;4-10,15-16H,1-3H3;4-10,15H,1-3H3;4-10,15H,1-3H3;4-8,16H,1-3H3;5-9,15H,1-4H3;2*4-9,16H,1-3H3,(H,14,15);4-8,15-16H,1-3H3;4-7,15H,1-3H3,(H,14,16);4-8,13-14H,1-3H3
InChIKeyGADDRMFTTUUYEV-UHFFFAOYSA-N
XLogP55.26
TPSA491.29 Ų
H-Bond Donors22
H-Bond Acceptors40
Rotatable Bonds34
Heavy Atoms254
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003555.50
LogP ≤ 555.26
H-Bond Donors ≤ 522
H-Bond Acceptors ≤ 1040

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}, {'alert_name': 'hydroquinone', 'substructure': 'N/A'}

Analyze 5-(tert-butylamino)-1-phenylpyridin-2-one;4-(tert-butylamino)-2-(1,3-thiazol-5-yl)phenol;5-(tert-butylamino)-3-(1,3-thiazol-5-yl)-1H-pyridin-2-one;N-tert-butyl-3-chloro-5-(1,3-thiazol-5-yl)aniline;N-tert-butyl-3-[3-[2-(dimethylamino)ethyl]imidazol-4-yl]aniline;N-tert-butyl-3-(1H-imidazol-2-yl)aniline;N-tert-butyl-1H-indol-4-amine;N-tert-butyl-4-methoxy-3-(1H-pyrrol-2-yl)aniline;N-tert-butyl-4-methoxy-3-(1,3-thiazol-5-yl)aniline;N-tert-butyl-4-methoxy-3-thiophen-3-ylaniline;N-tert-butyl-3-(4-methyl-1,2,4-triazol-3-yl)aniline;N-tert-butylnaphthalen-1-amine;N-tert-butyl-3-(1H-pyrazol-4-yl)aniline;N-tert-butyl-3-(1H-pyrrol-2-yl)aniline;N-tert-butyl-3-thiophen-3-ylaniline with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-(tert-butylamino)-1-phenylpyridin-2-one;4-(tert-butylamino)-2-(1,3-thiazol-5-yl)phenol;5-(tert-butylamino)-3-(1,3-thiazol-5-yl)-1H-pyridin-2-one;N-tert-butyl-3-chloro-5-(1,3-thiazol-5-yl)aniline;N-tert-butyl-3-[3-[2-(dimethylamino)ethyl]imidazol-4-yl]aniline;N-tert-butyl-3-(1H-imidazol-2-yl)aniline;N-tert-butyl-1H-indol-4-amine;N-tert-butyl-4-methoxy-3-(1H-pyrrol-2-yl)aniline;N-tert-butyl-4-methoxy-3-(1,3-thiazol-5-yl)aniline;N-tert-butyl-4-methoxy-3-thiophen-3-ylaniline;N-tert-butyl-3-(4-methyl-1,2,4-triazol-3-yl)aniline;N-tert-butylnaphthalen-1-amine;N-tert-butyl-3-(1H-pyrazol-4-yl)aniline;N-tert-butyl-3-(1H-pyrrol-2-yl)aniline;N-tert-butyl-3-thiophen-3-ylaniline?
The IUPAC name of 5-(tert-butylamino)-1-phenylpyridin-2-one;4-(tert-butylamino)-2-(1,3-thiazol-5-yl)phenol;5-(tert-butylamino)-3-(1,3-thiazol-5-yl)-1H-pyridin-2-one;N-tert-butyl-3-chloro-5-(1,3-thiazol-5-yl)aniline;N-tert-butyl-3-[3-[2-(dimethylamino)ethyl]imidazol-4-yl]aniline;N-tert-butyl-3-(1H-imidazol-2-yl)aniline;N-tert-butyl-1H-indol-4-amine;N-tert-butyl-4-methoxy-3-(1H-pyrrol-2-yl)aniline;N-tert-butyl-4-methoxy-3-(1,3-thiazol-5-yl)aniline;N-tert-butyl-4-methoxy-3-thiophen-3-ylaniline;N-tert-butyl-3-(4-methyl-1,2,4-triazol-3-yl)aniline;N-tert-butylnaphthalen-1-amine;N-tert-butyl-3-(1H-pyrazol-4-yl)aniline;N-tert-butyl-3-(1H-pyrrol-2-yl)aniline;N-tert-butyl-3-thiophen-3-ylaniline (CID 158194156) is 5-(tert-butylamino)-1-phenylpyridin-2-one;4-(tert-butylamino)-2-(1,3-thiazol-5-yl)phenol;5-(tert-butylamino)-3-(1,3-thiazol-5-yl)-1H-pyridin-2-one;N-tert-butyl-3-chloro-5-(1,3-thiazol-5-yl)aniline;N-tert-butyl-3-[3-[2-(dimethylamino)ethyl]imidazol-4-yl]aniline;N-tert-butyl-3-(1H-imidazol-2-yl)aniline;N-tert-butyl-1H-indol-4-amine;N-tert-butyl-4-methoxy-3-(1H-pyrrol-2-yl)aniline;N-tert-butyl-4-methoxy-3-(1,3-thiazol-5-yl)aniline;N-tert-butyl-4-methoxy-3-thiophen-3-ylaniline;N-tert-butyl-3-(4-methyl-1,2,4-triazol-3-yl)aniline;N-tert-butylnaphthalen-1-amine;N-tert-butyl-3-(1H-pyrazol-4-yl)aniline;N-tert-butyl-3-(1H-pyrrol-2-yl)aniline;N-tert-butyl-3-thiophen-3-ylaniline.
What is the SMILES notation for 5-(tert-butylamino)-1-phenylpyridin-2-one;4-(tert-butylamino)-2-(1,3-thiazol-5-yl)phenol;5-(tert-butylamino)-3-(1,3-thiazol-5-yl)-1H-pyridin-2-one;N-tert-butyl-3-chloro-5-(1,3-thiazol-5-yl)aniline;N-tert-butyl-3-[3-[2-(dimethylamino)ethyl]imidazol-4-yl]aniline;N-tert-butyl-3-(1H-imidazol-2-yl)aniline;N-tert-butyl-1H-indol-4-amine;N-tert-butyl-4-methoxy-3-(1H-pyrrol-2-yl)aniline;N-tert-butyl-4-methoxy-3-(1,3-thiazol-5-yl)aniline;N-tert-butyl-4-methoxy-3-thiophen-3-ylaniline;N-tert-butyl-3-(4-methyl-1,2,4-triazol-3-yl)aniline;N-tert-butylnaphthalen-1-amine;N-tert-butyl-3-(1H-pyrazol-4-yl)aniline;N-tert-butyl-3-(1H-pyrrol-2-yl)aniline;N-tert-butyl-3-thiophen-3-ylaniline?
The canonical SMILES for 5-(tert-butylamino)-1-phenylpyridin-2-one;4-(tert-butylamino)-2-(1,3-thiazol-5-yl)phenol;5-(tert-butylamino)-3-(1,3-thiazol-5-yl)-1H-pyridin-2-one;N-tert-butyl-3-chloro-5-(1,3-thiazol-5-yl)aniline;N-tert-butyl-3-[3-[2-(dimethylamino)ethyl]imidazol-4-yl]aniline;N-tert-butyl-3-(1H-imidazol-2-yl)aniline;N-tert-butyl-1H-indol-4-amine;N-tert-butyl-4-methoxy-3-(1H-pyrrol-2-yl)aniline;N-tert-butyl-4-methoxy-3-(1,3-thiazol-5-yl)aniline;N-tert-butyl-4-methoxy-3-thiophen-3-ylaniline;N-tert-butyl-3-(4-methyl-1,2,4-triazol-3-yl)aniline;N-tert-butylnaphthalen-1-amine;N-tert-butyl-3-(1H-pyrazol-4-yl)aniline;N-tert-butyl-3-(1H-pyrrol-2-yl)aniline;N-tert-butyl-3-thiophen-3-ylaniline is CC(C)(C)Nc1c[nH]c(=O)c(-c2cncs2)c1.CC(C)(C)Nc1cc(Cl)cc(-c2cncs2)c1.CC(C)(C)Nc1ccc(=O)n(-c2ccccc2)c1.CC(C)(C)Nc1ccc(O)c(-c2cncs2)c1.CC(C)(C)Nc1cccc(-c2ccc[nH]2)c1.CC(C)(C)Nc1cccc(-c2ccsc2)c1.CC(C)(C)Nc1cccc(-c2cn[nH]c2)c1.CC(C)(C)Nc1cccc(-c2ncc[nH]2)c1.CC(C)(C)Nc1cccc2[nH]ccc12.CC(C)(C)Nc1cccc2ccccc12.CN(C)CCn1cncc1-c1cccc(NC(C)(C)C)c1.COc1ccc(NC(C)(C)C)cc1-c1ccc[nH]1.COc1ccc(NC(C)(C)C)cc1-c1ccsc1.COc1ccc(NC(C)(C)C)cc1-c1cncs1.Cn1cnnc1-c1cccc(NC(C)(C)C)c1.
What is the InChIKey of 5-(tert-butylamino)-1-phenylpyridin-2-one;4-(tert-butylamino)-2-(1,3-thiazol-5-yl)phenol;5-(tert-butylamino)-3-(1,3-thiazol-5-yl)-1H-pyridin-2-one;N-tert-butyl-3-chloro-5-(1,3-thiazol-5-yl)aniline;N-tert-butyl-3-[3-[2-(dimethylamino)ethyl]imidazol-4-yl]aniline;N-tert-butyl-3-(1H-imidazol-2-yl)aniline;N-tert-butyl-1H-indol-4-amine;N-tert-butyl-4-methoxy-3-(1H-pyrrol-2-yl)aniline;N-tert-butyl-4-methoxy-3-(1,3-thiazol-5-yl)aniline;N-tert-butyl-4-methoxy-3-thiophen-3-ylaniline;N-tert-butyl-3-(4-methyl-1,2,4-triazol-3-yl)aniline;N-tert-butylnaphthalen-1-amine;N-tert-butyl-3-(1H-pyrazol-4-yl)aniline;N-tert-butyl-3-(1H-pyrrol-2-yl)aniline;N-tert-butyl-3-thiophen-3-ylaniline?
The InChIKey is GADDRMFTTUUYEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N4.C15H20N2O.C15H18N2O.C15H19NOS.C14H18N2OS.C14H18N2.C14H17NS.C14H17N.C13H15ClN2S.C13H18N4.2C13H17N3.C13H16N2OS.C12H15N3OS.C12H16N2/c1-17(2,3)19-15-8-6-7-14(11-15)16-12-18-13-21(16)10-9-20(4)5;1-15(2,3)17-11-7-8-14(18-4)12(10-11)13-6-5-9-16-13;1-15(2,3)16-12-9-10-14(18)17(11-12)13-7-5-4-6-8-13;1-15(2,3)16-12-5-6-14(17-4)13(9-12)11-7-8-18-10-11;1-14(2,3)16-10-5-6-12(17-4)11(7-10)13-8-15-9-18-13;1-14(2,3)16-12-7-4-6-11(10-12)13-8-5-9-15-13;1-14(2,3)15-13-6-4-5-11(9-13)12-7-8-16-10-12;1-14(2,3)15-13-10-6-8-11-7-4-5-9-12(11)13;1-13(2,3)16-11-5-9(4-10(14)6-11)12-7-15-8-17-12;1-13(2,3)15-11-7-5-6-10(8-11)12-16-14-9-17(12)4;1-13(2,3)16-12-6-4-5-10(7-12)11-8-14-15-9-11;1-13(2,3)16-11-6-4-5-10(9-11)12-14-7-8-15-12;1-13(2,3)15-9-4-5-11(16)10(6-9)12-7-14-8-17-12;1-12(2,3)15-8-4-9(11(16)14-5-8)10-6-13-7-17-10;1-12(2,3)14-11-6-4-5-10-9(11)7-8-13-10/h6-8,11-13,19H,9-10H2,1-5H3;5-10,16-17H,1-4H3;4-11,16H,1-3H3;5-10,16H,1-4H3;5-9,16H,1-4H3;4-10,15-16H,1-3H3;4-10,15H,1-3H3;4-10,15H,1-3H3;4-8,16H,1-3H3;5-9,15H,1-4H3;2*4-9,16H,1-3H3,(H,14,15);4-8,15-16H,1-3H3;4-7,15H,1-3H3,(H,14,16);4-8,13-14H,1-3H3.
What are the key properties of 5-(tert-butylamino)-1-phenylpyridin-2-one;4-(tert-butylamino)-2-(1,3-thiazol-5-yl)phenol;5-(tert-butylamino)-3-(1,3-thiazol-5-yl)-1H-pyridin-2-one;N-tert-butyl-3-chloro-5-(1,3-thiazol-5-yl)aniline;N-tert-butyl-3-[3-[2-(dimethylamino)ethyl]imidazol-4-yl]aniline;N-tert-butyl-3-(1H-imidazol-2-yl)aniline;N-tert-butyl-1H-indol-4-amine;N-tert-butyl-4-methoxy-3-(1H-pyrrol-2-yl)aniline;N-tert-butyl-4-methoxy-3-(1,3-thiazol-5-yl)aniline;N-tert-butyl-4-methoxy-3-thiophen-3-ylaniline;N-tert-butyl-3-(4-methyl-1,2,4-triazol-3-yl)aniline;N-tert-butylnaphthalen-1-amine;N-tert-butyl-3-(1H-pyrazol-4-yl)aniline;N-tert-butyl-3-(1H-pyrrol-2-yl)aniline;N-tert-butyl-3-thiophen-3-ylaniline?
5-(tert-butylamino)-1-phenylpyridin-2-one;4-(tert-butylamino)-2-(1,3-thiazol-5-yl)phenol;5-(tert-butylamino)-3-(1,3-thiazol-5-yl)-1H-pyridin-2-one;N-tert-butyl-3-chloro-5-(1,3-thiazol-5-yl)aniline;N-tert-butyl-3-[3-[2-(dimethylamino)ethyl]imidazol-4-yl]aniline;N-tert-butyl-3-(1H-imidazol-2-yl)aniline;N-tert-butyl-1H-indol-4-amine;N-tert-butyl-4-methoxy-3-(1H-pyrrol-2-yl)aniline;N-tert-butyl-4-methoxy-3-(1,3-thiazol-5-yl)aniline;N-tert-butyl-4-methoxy-3-thiophen-3-ylaniline;N-tert-butyl-3-(4-methyl-1,2,4-triazol-3-yl)aniline;N-tert-butylnaphthalen-1-amine;N-tert-butyl-3-(1H-pyrazol-4-yl)aniline;N-tert-butyl-3-(1H-pyrrol-2-yl)aniline;N-tert-butyl-3-thiophen-3-ylaniline has a molecular weight of 3555.50 g/mol, XLogP of 55.26, 34 rotatable bonds, 22 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(tert-butylamino)-1-phenylpyridin-2-one;4-(tert-butylamino)-2-(1,3-thiazol-5-yl)phenol;5-(tert-butylamino)-3-(1,3-thiazol-5-yl)-1H-pyridin-2-one;N-tert-butyl-3-chloro-5-(1,3-thiazol-5-yl)aniline;N-tert-butyl-3-[3-[2-(dimethylamino)ethyl]imidazol-4-yl]aniline;N-tert-butyl-3-(1H-imidazol-2-yl)aniline;N-tert-butyl-1H-indol-4-amine;N-tert-butyl-4-methoxy-3-(1H-pyrrol-2-yl)aniline;N-tert-butyl-4-methoxy-3-(1,3-thiazol-5-yl)aniline;N-tert-butyl-4-methoxy-3-thiophen-3-ylaniline;N-tert-butyl-3-(4-methyl-1,2,4-triazol-3-yl)aniline;N-tert-butylnaphthalen-1-amine;N-tert-butyl-3-(1H-pyrazol-4-yl)aniline;N-tert-butyl-3-(1H-pyrrol-2-yl)aniline;N-tert-butyl-3-thiophen-3-ylaniline is sourced from PubChem (CID 158194156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).