2-N-(2-aminocyclohexyl)cyclohexane-1,2-diamine;2-N-[2-(dimethylamino)-5-methylphenyl]-1-N,1-N,2-N,4-tetramethylbenzene-1,2-diamine;2-N-[2-(dimethylamino)phenyl]-1-N,1-N,2-N-trimethylbenzene-1,2-diamine;1-N-[2-(dimethylamino)-4-(trifluoromethyl)phenyl]-1-N,2-N,2-N,4-tetramethylbenzene-1,2-diamine;1-(6-methyl-2-pyridinyl)-N-[(6-methyl-2-pyridinyl)methyl]methanamine;2-(5-pyridin-2-ylpentyl)pyridine;2-(6-pyridin-2-ylpiperidin-2-yl)pyridine;1-pyridin-2-yl-N-(1-pyridin-2-ylethyl)ethanamine;1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine;1-pyrimidin-2-yl-N-(pyrimidin-2-ylmethyl)methanamine;9H-xanthene-4,5-diamine

C160H204F3N33O — CID 162055282

About 2-N-(2-aminocyclohexyl)cyclohexane-1,2-diamine;2-N-[2-(dimethylamino)-5-methylphenyl]-1-N,1-N,2-N,4-tetramethylbenzene-1,2-diamine;2-N-[2-(dimethylamino)phenyl]-1-N,1-N,2-N-trimethylbenzene-1,2-diamine;1-N-[2-(dimethylamino)-4-(trifluoromethyl)phenyl]-1-N,2-N,2-N,4-tetramethylbenzene-1,2-diamine;1-(6-methyl-2-pyridinyl)-N-[(6-methyl-2-pyridinyl)methyl]methanamine;2-(5-pyridin-2-ylpentyl)pyridine;2-(6-pyridin-2-ylpiperidin-2-yl)pyridine;1-pyridin-2-yl-N-(1-pyridin-2-ylethyl)ethanamine;1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine;1-pyrimidin-2-yl-N-(pyrimidin-2-ylmethyl)methanamine;9H-xanthene-4,5-diamine

2-N-(2-aminocyclohexyl)cyclohexane-1,2-diamine;2-N-[2-(dimethylamino)-5-methylphenyl]-1-N,1-N,2-N,4-tetramethylbenzene-1,2-diamine;2-N-[2-(dimethylamino)phenyl]-1-N,1-N,2-N-trimethylbenzene-1,2-diamine;1-N-[2-(dimethylamino)-4-(trifluoromethyl)phenyl]-1-N,2-N,2-N,4-tetramethylbenzene-1,2-diamine;1-(6-methyl-2-pyridinyl)-N-[(6-methyl-2-pyridinyl)methyl]methanamine;2-(5-pyridin-2-ylpentyl)pyridine;2-(6-pyridin-2-ylpiperidin-2-yl)pyridine;1-pyridin-2-yl-N-(1-pyridin-2-ylethyl)ethanamine;1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine;1-pyrimidin-2-yl-N-(pyrimidin-2-ylmethyl)methanamine;9H-xanthene-4,5-diamine (PubChem CID 162055282) has the molecular formula C160H204F3N33O and a molecular weight of 2662.62 g/mol. Its IUPAC name is 2-N-(2-aminocyclohexyl)cyclohexane-1,2-diamine;2-N-[2-(dimethylamino)-5-methylphenyl]-1-N,1-N,2-N,4-tetramethylbenzene-1,2-diamine;2-N-[2-(dimethylamino)phenyl]-1-N,1-N,2-N-trimethylbenzene-1,2-diamine;1-N-[2-(dimethylamino)-4-(trifluoromethyl)phenyl]-1-N,2-N,2-N,4-tetramethylbenzene-1,2-diamine;1-(6-methyl-2-pyridinyl)-N-[(6-methyl-2-pyridinyl)methyl]methanamine;2-(5-pyridin-2-ylpentyl)pyridine;2-(6-pyridin-2-ylpiperidin-2-yl)pyridine;1-pyridin-2-yl-N-(1-pyridin-2-ylethyl)ethanamine;1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine;1-pyrimidin-2-yl-N-(pyrimidin-2-ylmethyl)methanamine;9H-xanthene-4,5-diamine.

Molecular Properties

• Compound Name: 2-N-(2-aminocyclohexyl)cyclohexane-1,2-diamine;2-N-[2-(dimethylamino)-5-methylphenyl]-1-N,1-N,2-N,4-tetramethylbenzene-1,2-diamine;2-N-[2-(dimethylamino)phenyl]-1-N,1-N,2-N-trimethylbenzene-1,2-diamine;1-N-[2-(dimethylamino)-4-(trifluoromethyl)phenyl]-1-N,2-N,2-N,4-tetramethylbenzene-1,2-diamine;1-(6-methyl-2-pyridinyl)-N-[(6-methyl-2-pyridinyl)methyl]methanamine;2-(5-pyridin-2-ylpentyl)pyridine;2-(6-pyridin-2-ylpiperidin-2-yl)pyridine;1-pyridin-2-yl-N-(1-pyridin-2-ylethyl)ethanamine;1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine;1-pyrimidin-2-yl-N-(pyrimidin-2-ylmethyl)methanamine;9H-xanthene-4,5-diamine
• PubChem CID: 162055282
• Molecular Formula: C160H204F3N33O
• Molecular Weight: 2662.62 g/mol
• Exact Mass: 2660.69
• IUPAC Name: 2-N-(2-aminocyclohexyl)cyclohexane-1,2-diamine;2-N-[2-(dimethylamino)-5-methylphenyl]-1-N,1-N,2-N,4-tetramethylbenzene-1,2-diamine;2-N-[2-(dimethylamino)phenyl]-1-N,1-N,2-N-trimethylbenzene-1,2-diamine;1-N-[2-(dimethylamino)-4-(trifluoromethyl)phenyl]-1-N,2-N,2-N,4-tetramethylbenzene-1,2-diamine;1-(6-methyl-2-pyridinyl)-N-[(6-methyl-2-pyridinyl)methyl]methanamine;2-(5-pyridin-2-ylpentyl)pyridine;2-(6-pyridin-2-ylpiperidin-2-yl)pyridine;1-pyridin-2-yl-N-(1-pyridin-2-ylethyl)ethanamine;1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine;1-pyrimidin-2-yl-N-(pyrimidin-2-ylmethyl)methanamine;9H-xanthene-4,5-diamine
• SMILES: CC(NC(C)c1ccccn1)c1ccccn1.CN(C)c1ccccc1N(C)c1ccccc1N(C)C.Cc1ccc(N(C)C)c(N(C)c2cc(C)ccc2N(C)C)c1.Cc1ccc(N(C)c2ccc(C(F)(F)F)cc2N(C)C)c(N(C)C)c1.Cc1cccc(CNCc2cccc(C)n2)n1.NC1CCCCC1NC1CCCCC1N.Nc1cccc2c1Oc1c(N)cccc1C2.c1ccc(C2CCCC(c3ccccn3)N2)nc1.c1ccc(CCCCCc2ccccn2)nc1.c1ccc(CNCc2ccccn2)nc1.c1cnc(CNCc2ncccn2)nc1
• InChI: InChI=1S/C19H24F3N3.C19H27N3.C17H23N3.C15H17N3.C15H18N2.2C14H17N3.C13H12N2O.C12H13N3.C12H25N3.C10H11N5/c1-13-7-9-15(17(11-13)23(2)3)25(6)16-10-8-14(19(20,21)22)12-18(16)24(4)5;1-14-8-10-16(20(3)4)18(12-14)22(7)19-13-15(2)9-11-17(19)21(5)6;1-18(2)14-10-6-8-12-16(14)20(5)17-13-9-7-11-15(17)19(3)4;1-3-10-16-12(6-1)14-8-5-9-15(18-14)13-7-2-4-11-17-13;1(2-8-14-10-4-6-12-16-14)3-9-15-11-5-7-13-17-15;1-11-5-3-7-13(16-11)9-15-10-14-8-4-6-12(2)17-14;1-11(13-7-3-5-9-15-13)17-12(2)14-8-4-6-10-16-14;14-10-5-1-3-8-7-9-4-2-6-11(15)13(9)16-12(8)10;1-3-7-14-11(5-1)9-13-10-12-6-2-4-8-15-12;13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)14;1-3-12-9(13-4-1)7-11-8-10-14-5-2-6-15-10/h7-12H,1-6H3;8-13H,1-7H3;6-13H,1-5H3;1-4,6-7,10-11,14-15,18H,5,8-9H2;4-7,10-13H,1-3,8-9H2;3-8,15H,9-10H2,1-2H3;3-12,17H,1-2H3;1-6H,7,14-15H2;1-8,13H,9-10H2;9-12,15H,1-8,13-14H2;1-6,11H,7-8H2
• InChIKey: YZCBAXPLMSBRII-UHFFFAOYSA-N
• XLogP: 30.43
• TPSA: 395.11 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 34
• Rotatable Bonds: 38
• Heavy Atoms: 197
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2662.62
LogP ≤ 5	30.43
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	34

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-N-(2-aminocyclohexyl)cyclohexane-1,2-diamine;2-N-[2-(dimethylamino)-5-methylphenyl]-1-N,1-N,2-N,4-tetramethylbenzene-1,2-diamine;2-N-[2-(dimethylamino)phenyl]-1-N,1-N,2-N-trimethylbenzene-1,2-diamine;1-N-[2-(dimethylamino)-4-(trifluoromethyl)phenyl]-1-N,2-N,2-N,4-tetramethylbenzene-1,2-diamine;1-(6-methyl-2-pyridinyl)-N-[(6-methyl-2-pyridinyl)methyl]methanamine;2-(5-pyridin-2-ylpentyl)pyridine;2-(6-pyridin-2-ylpiperidin-2-yl)pyridine;1-pyridin-2-yl-N-(1-pyridin-2-ylethyl)ethanamine;1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine;1-pyrimidin-2-yl-N-(pyrimidin-2-ylmethyl)methanamine;9H-xanthene-4,5-diamine?

The IUPAC name of 2-N-(2-aminocyclohexyl)cyclohexane-1,2-diamine;2-N-[2-(dimethylamino)-5-methylphenyl]-1-N,1-N,2-N,4-tetramethylbenzene-1,2-diamine;2-N-[2-(dimethylamino)phenyl]-1-N,1-N,2-N-trimethylbenzene-1,2-diamine;1-N-[2-(dimethylamino)-4-(trifluoromethyl)phenyl]-1-N,2-N,2-N,4-tetramethylbenzene-1,2-diamine;1-(6-methyl-2-pyridinyl)-N-[(6-methyl-2-pyridinyl)methyl]methanamine;2-(5-pyridin-2-ylpentyl)pyridine;2-(6-pyridin-2-ylpiperidin-2-yl)pyridine;1-pyridin-2-yl-N-(1-pyridin-2-ylethyl)ethanamine;1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine;1-pyrimidin-2-yl-N-(pyrimidin-2-ylmethyl)methanamine;9H-xanthene-4,5-diamine (CID 162055282) is 2-N-(2-aminocyclohexyl)cyclohexane-1,2-diamine;2-N-[2-(dimethylamino)-5-methylphenyl]-1-N,1-N,2-N,4-tetramethylbenzene-1,2-diamine;2-N-[2-(dimethylamino)phenyl]-1-N,1-N,2-N-trimethylbenzene-1,2-diamine;1-N-[2-(dimethylamino)-4-(trifluoromethyl)phenyl]-1-N,2-N,2-N,4-tetramethylbenzene-1,2-diamine;1-(6-methyl-2-pyridinyl)-N-[(6-methyl-2-pyridinyl)methyl]methanamine;2-(5-pyridin-2-ylpentyl)pyridine;2-(6-pyridin-2-ylpiperidin-2-yl)pyridine;1-pyridin-2-yl-N-(1-pyridin-2-ylethyl)ethanamine;1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine;1-pyrimidin-2-yl-N-(pyrimidin-2-ylmethyl)methanamine;9H-xanthene-4,5-diamine.

What is the SMILES notation for 2-N-(2-aminocyclohexyl)cyclohexane-1,2-diamine;2-N-[2-(dimethylamino)-5-methylphenyl]-1-N,1-N,2-N,4-tetramethylbenzene-1,2-diamine;2-N-[2-(dimethylamino)phenyl]-1-N,1-N,2-N-trimethylbenzene-1,2-diamine;1-N-[2-(dimethylamino)-4-(trifluoromethyl)phenyl]-1-N,2-N,2-N,4-tetramethylbenzene-1,2-diamine;1-(6-methyl-2-pyridinyl)-N-[(6-methyl-2-pyridinyl)methyl]methanamine;2-(5-pyridin-2-ylpentyl)pyridine;2-(6-pyridin-2-ylpiperidin-2-yl)pyridine;1-pyridin-2-yl-N-(1-pyridin-2-ylethyl)ethanamine;1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine;1-pyrimidin-2-yl-N-(pyrimidin-2-ylmethyl)methanamine;9H-xanthene-4,5-diamine?

The canonical SMILES for 2-N-(2-aminocyclohexyl)cyclohexane-1,2-diamine;2-N-[2-(dimethylamino)-5-methylphenyl]-1-N,1-N,2-N,4-tetramethylbenzene-1,2-diamine;2-N-[2-(dimethylamino)phenyl]-1-N,1-N,2-N-trimethylbenzene-1,2-diamine;1-N-[2-(dimethylamino)-4-(trifluoromethyl)phenyl]-1-N,2-N,2-N,4-tetramethylbenzene-1,2-diamine;1-(6-methyl-2-pyridinyl)-N-[(6-methyl-2-pyridinyl)methyl]methanamine;2-(5-pyridin-2-ylpentyl)pyridine;2-(6-pyridin-2-ylpiperidin-2-yl)pyridine;1-pyridin-2-yl-N-(1-pyridin-2-ylethyl)ethanamine;1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine;1-pyrimidin-2-yl-N-(pyrimidin-2-ylmethyl)methanamine;9H-xanthene-4,5-diamine is CC(NC(C)c1ccccn1)c1ccccn1.CN(C)c1ccccc1N(C)c1ccccc1N(C)C.Cc1ccc(N(C)C)c(N(C)c2cc(C)ccc2N(C)C)c1.Cc1ccc(N(C)c2ccc(C(F)(F)F)cc2N(C)C)c(N(C)C)c1.Cc1cccc(CNCc2cccc(C)n2)n1.NC1CCCCC1NC1CCCCC1N.Nc1cccc2c1Oc1c(N)cccc1C2.c1ccc(C2CCCC(c3ccccn3)N2)nc1.c1ccc(CCCCCc2ccccn2)nc1.c1ccc(CNCc2ccccn2)nc1.c1cnc(CNCc2ncccn2)nc1.

What is the InChIKey of 2-N-(2-aminocyclohexyl)cyclohexane-1,2-diamine;2-N-[2-(dimethylamino)-5-methylphenyl]-1-N,1-N,2-N,4-tetramethylbenzene-1,2-diamine;2-N-[2-(dimethylamino)phenyl]-1-N,1-N,2-N-trimethylbenzene-1,2-diamine;1-N-[2-(dimethylamino)-4-(trifluoromethyl)phenyl]-1-N,2-N,2-N,4-tetramethylbenzene-1,2-diamine;1-(6-methyl-2-pyridinyl)-N-[(6-methyl-2-pyridinyl)methyl]methanamine;2-(5-pyridin-2-ylpentyl)pyridine;2-(6-pyridin-2-ylpiperidin-2-yl)pyridine;1-pyridin-2-yl-N-(1-pyridin-2-ylethyl)ethanamine;1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine;1-pyrimidin-2-yl-N-(pyrimidin-2-ylmethyl)methanamine;9H-xanthene-4,5-diamine?

The InChIKey is YZCBAXPLMSBRII-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24F3N3.C19H27N3.C17H23N3.C15H17N3.C15H18N2.2C14H17N3.C13H12N2O.C12H13N3.C12H25N3.C10H11N5/c1-13-7-9-15(17(11-13)23(2)3)25(6)16-10-8-14(19(20,21)22)12-18(16)24(4)5;1-14-8-10-16(20(3)4)18(12-14)22(7)19-13-15(2)9-11-17(19)21(5)6;1-18(2)14-10-6-8-12-16(14)20(5)17-13-9-7-11-15(17)19(3)4;1-3-10-16-12(6-1)14-8-5-9-15(18-14)13-7-2-4-11-17-13;1(2-8-14-10-4-6-12-16-14)3-9-15-11-5-7-13-17-15;1-11-5-3-7-13(16-11)9-15-10-14-8-4-6-12(2)17-14;1-11(13-7-3-5-9-15-13)17-12(2)14-8-4-6-10-16-14;14-10-5-1-3-8-7-9-4-2-6-11(15)13(9)16-12(8)10;1-3-7-14-11(5-1)9-13-10-12-6-2-4-8-15-12;13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)14;1-3-12-9(13-4-1)7-11-8-10-14-5-2-6-15-10/h7-12H,1-6H3;8-13H,1-7H3;6-13H,1-5H3;1-4,6-7,10-11,14-15,18H,5,8-9H2;4-7,10-13H,1-3,8-9H2;3-8,15H,9-10H2,1-2H3;3-12,17H,1-2H3;1-6H,7,14-15H2;1-8,13H,9-10H2;9-12,15H,1-8,13-14H2;1-6,11H,7-8H2.

What are the key properties of 2-N-(2-aminocyclohexyl)cyclohexane-1,2-diamine;2-N-[2-(dimethylamino)-5-methylphenyl]-1-N,1-N,2-N,4-tetramethylbenzene-1,2-diamine;2-N-[2-(dimethylamino)phenyl]-1-N,1-N,2-N-trimethylbenzene-1,2-diamine;1-N-[2-(dimethylamino)-4-(trifluoromethyl)phenyl]-1-N,2-N,2-N,4-tetramethylbenzene-1,2-diamine;1-(6-methyl-2-pyridinyl)-N-[(6-methyl-2-pyridinyl)methyl]methanamine;2-(5-pyridin-2-ylpentyl)pyridine;2-(6-pyridin-2-ylpiperidin-2-yl)pyridine;1-pyridin-2-yl-N-(1-pyridin-2-ylethyl)ethanamine;1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine;1-pyrimidin-2-yl-N-(pyrimidin-2-ylmethyl)methanamine;9H-xanthene-4,5-diamine?

2-N-(2-aminocyclohexyl)cyclohexane-1,2-diamine;2-N-[2-(dimethylamino)-5-methylphenyl]-1-N,1-N,2-N,4-tetramethylbenzene-1,2-diamine;2-N-[2-(dimethylamino)phenyl]-1-N,1-N,2-N-trimethylbenzene-1,2-diamine;1-N-[2-(dimethylamino)-4-(trifluoromethyl)phenyl]-1-N,2-N,2-N,4-tetramethylbenzene-1,2-diamine;1-(6-methyl-2-pyridinyl)-N-[(6-methyl-2-pyridinyl)methyl]methanamine;2-(5-pyridin-2-ylpentyl)pyridine;2-(6-pyridin-2-ylpiperidin-2-yl)pyridine;1-pyridin-2-yl-N-(1-pyridin-2-ylethyl)ethanamine;1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine;1-pyrimidin-2-yl-N-(pyrimidin-2-ylmethyl)methanamine;9H-xanthene-4,5-diamine has a molecular weight of 2662.62 g/mol, XLogP of 30.43, 38 rotatable bonds, 10 hydrogen bond donors, and 34 hydrogen bond acceptors.

Where does this data come from?

All data for 2-N-(2-aminocyclohexyl)cyclohexane-1,2-diamine;2-N-[2-(dimethylamino)-5-methylphenyl]-1-N,1-N,2-N,4-tetramethylbenzene-1,2-diamine;2-N-[2-(dimethylamino)phenyl]-1-N,1-N,2-N-trimethylbenzene-1,2-diamine;1-N-[2-(dimethylamino)-4-(trifluoromethyl)phenyl]-1-N,2-N,2-N,4-tetramethylbenzene-1,2-diamine;1-(6-methyl-2-pyridinyl)-N-[(6-methyl-2-pyridinyl)methyl]methanamine;2-(5-pyridin-2-ylpentyl)pyridine;2-(6-pyridin-2-ylpiperidin-2-yl)pyridine;1-pyridin-2-yl-N-(1-pyridin-2-ylethyl)ethanamine;1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine;1-pyrimidin-2-yl-N-(pyrimidin-2-ylmethyl)methanamine;9H-xanthene-4,5-diamine is sourced from PubChem (CID 162055282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).