5-amino-N-(2,3-dimethylcyclohexyl)-2-methylcyclohexane-1-carboxamide

C16H30N2O — CID 62781644

IUPAC5-amino-N-(2,3-dimethylcyclohexyl)-2-methylcyclohexane-1-carboxamide
SMILESCC1CCC(N)CC1C(=O)NC1CCCC(C)C1C
InChIInChI=1S/C16H30N2O/c1-10-5-4-6-15(12(10)3)18-16(19)14-9-13(17)8-7-11(14)2/h10-15H,4-9,17H2,1-3H3,(H,18,19)
InChIKeyQRZZGRVMPCIHLU-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.69
Rot. Bonds2

About 5-amino-N-(2,3-dimethylcyclohexyl)-2-methylcyclohexane-1-carboxamide

5-amino-N-(2,3-dimethylcyclohexyl)-2-methylcyclohexane-1-carboxamide (PubChem CID 62781644) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is 5-amino-N-(2,3-dimethylcyclohexyl)-2-methylcyclohexane-1-carboxamide.

Molecular Properties

Compound Name5-amino-N-(2,3-dimethylcyclohexyl)-2-methylcyclohexane-1-carboxamide
PubChem CID62781644
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC Name5-amino-N-(2,3-dimethylcyclohexyl)-2-methylcyclohexane-1-carboxamide
SMILESCC1CCC(N)CC1C(=O)NC1CCCC(C)C1C
InChIInChI=1S/C16H30N2O/c1-10-5-4-6-15(12(10)3)18-16(19)14-9-13(17)8-7-11(14)2/h10-15H,4-9,17H2,1-3H3,(H,18,19)
InChIKeyQRZZGRVMPCIHLU-UHFFFAOYSA-N
XLogP2.69
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N-(2,3-dimethylcyclohexyl)cyclopentane-1-carboxamide;hydrochloride
CID 119676180
4-amino-2-methyl-N-(2-methylcyclohexyl)cyclohexane-1-carboxamide
CID 62781647
5-amino-N-cycloheptyl-2-methylcyclohexane-1-carboxamide
CID 62783163
2-methyl-N-(2-methylcyclohexyl)cyclopropane-1-carboxamide
CID 4084655
N-(3-aminocyclohexyl)-2-methylcyclopropane-1-carboxamide
CID 130816162
2-[(2-methylcyclopentanecarbonyl)amino]cyclohexane-1-carboxylic acid
CID 107175594
2-[(2,3-dimethylcyclohexyl)amino]cyclobutane-1-carboxylic acid
CID 103234715
2-[(4-aminocyclohexyl)-methylamino]-N-(2,3-dimethylcyclohexyl)acetamide
CID 79113302
2-[(2,3-dimethylcyclopentyl)carbamoyl]-4-ethylcyclopentane-1-carboxylic acid
CID 114511889
methyl (1S,2R,5S)-5-amino-2-methylcyclohexane-1-carboxylate
CID 155905120
2-[(2,3-dimethylcyclohexyl)amino]-2-oxoacetic acid
CID 43445011
N-(2,3-dimethylcyclohexyl)-3-methylpiperidine-2-carboxamide
CID 55060363

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(2,3-dimethylcyclohexyl)-2-methylcyclohexane-1-carboxamide?
The IUPAC name of 5-amino-N-(2,3-dimethylcyclohexyl)-2-methylcyclohexane-1-carboxamide (CID 62781644) is 5-amino-N-(2,3-dimethylcyclohexyl)-2-methylcyclohexane-1-carboxamide.
What is the SMILES notation for 5-amino-N-(2,3-dimethylcyclohexyl)-2-methylcyclohexane-1-carboxamide?
The canonical SMILES for 5-amino-N-(2,3-dimethylcyclohexyl)-2-methylcyclohexane-1-carboxamide is CC1CCC(N)CC1C(=O)NC1CCCC(C)C1C.
What is the InChIKey of 5-amino-N-(2,3-dimethylcyclohexyl)-2-methylcyclohexane-1-carboxamide?
The InChIKey is QRZZGRVMPCIHLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-10-5-4-6-15(12(10)3)18-16(19)14-9-13(17)8-7-11(14)2/h10-15H,4-9,17H2,1-3H3,(H,18,19).
What are the key properties of 5-amino-N-(2,3-dimethylcyclohexyl)-2-methylcyclohexane-1-carboxamide?
5-amino-N-(2,3-dimethylcyclohexyl)-2-methylcyclohexane-1-carboxamide has a molecular weight of 266.43 g/mol, XLogP of 2.69, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(2,3-dimethylcyclohexyl)-2-methylcyclohexane-1-carboxamide is sourced from PubChem (CID 62781644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).