1-amino-N,3-dimethyl-N-(4-methylcyclohexyl)cyclohexane-1-carboxamide

C16H30N2O — CID 64549415

IUPAC1-amino-N,3-dimethyl-N-(4-methylcyclohexyl)cyclohexane-1-carboxamide
SMILESCC1CCC(N(C)C(=O)C2(N)CCCC(C)C2)CC1
InChIInChI=1S/C16H30N2O/c1-12-6-8-14(9-7-12)18(3)15(19)16(17)10-4-5-13(2)11-16/h12-14H,4-11,17H2,1-3H3
InChIKeyFTVUTKUKWONLBY-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.93
Rot. Bonds2

About 1-amino-N,3-dimethyl-N-(4-methylcyclohexyl)cyclohexane-1-carboxamide

1-amino-N,3-dimethyl-N-(4-methylcyclohexyl)cyclohexane-1-carboxamide (PubChem CID 64549415) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is 1-amino-N,3-dimethyl-N-(4-methylcyclohexyl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N,3-dimethyl-N-(4-methylcyclohexyl)cyclohexane-1-carboxamide
PubChem CID64549415
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC Name1-amino-N,3-dimethyl-N-(4-methylcyclohexyl)cyclohexane-1-carboxamide
SMILESCC1CCC(N(C)C(=O)C2(N)CCCC(C)C2)CC1
InChIInChI=1S/C16H30N2O/c1-12-6-8-14(9-7-12)18(3)15(19)16(17)10-4-5-13(2)11-16/h12-14H,4-11,17H2,1-3H3
InChIKeyFTVUTKUKWONLBY-UHFFFAOYSA-N
XLogP2.93
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-amino-N-(1-ethylpiperidin-4-yl)-N,3-dimethylcyclohexane-1-carboxamide
CID 64551045
1-amino-N-cyclopropyl-3-methyl-N-propylcyclohexane-1-carboxamide
CID 64550261
1-amino-N-[(1-hydroxycyclopentyl)methyl]-N,3-dimethylcyclohexane-1-carboxamide
CID 114948978
2-[(1-amino-3-methylcyclohexanecarbonyl)-methylamino]acetic acid
CID 64555060
2-[(1-amino-3-methylcyclohexanecarbonyl)-cyclopropylamino]acetic acid
CID 64552528
cis-(1S,3S)-1-amino-3-methylcyclohexane-1-carboxamide
CID 93311266
1-amino-3-methyl-N,N-dipentylcyclohexane-1-carboxamide
CID 64549829
1-amino-N,3-dimethyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)cyclohexane-1-carboxamide
CID 64553576
2-[(1-amino-3-methylcyclohexanecarbonyl)-methylamino]butanoic acid
CID 64554226
1-amino-N-(cyclopropylmethyl)-3-methyl-N-propylcyclohexane-1-carboxamide
CID 64551240
1-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-N,3-dimethylcyclohexane-1-carboxamide
CID 64551042
1-(1-amino-3-methylcyclohexyl)-2-cyclopropylethanone
CID 116579394

Frequently Asked Questions

What is the IUPAC name of 1-amino-N,3-dimethyl-N-(4-methylcyclohexyl)cyclohexane-1-carboxamide?
The IUPAC name of 1-amino-N,3-dimethyl-N-(4-methylcyclohexyl)cyclohexane-1-carboxamide (CID 64549415) is 1-amino-N,3-dimethyl-N-(4-methylcyclohexyl)cyclohexane-1-carboxamide.
What is the SMILES notation for 1-amino-N,3-dimethyl-N-(4-methylcyclohexyl)cyclohexane-1-carboxamide?
The canonical SMILES for 1-amino-N,3-dimethyl-N-(4-methylcyclohexyl)cyclohexane-1-carboxamide is CC1CCC(N(C)C(=O)C2(N)CCCC(C)C2)CC1.
What is the InChIKey of 1-amino-N,3-dimethyl-N-(4-methylcyclohexyl)cyclohexane-1-carboxamide?
The InChIKey is FTVUTKUKWONLBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-12-6-8-14(9-7-12)18(3)15(19)16(17)10-4-5-13(2)11-16/h12-14H,4-11,17H2,1-3H3.
What are the key properties of 1-amino-N,3-dimethyl-N-(4-methylcyclohexyl)cyclohexane-1-carboxamide?
1-amino-N,3-dimethyl-N-(4-methylcyclohexyl)cyclohexane-1-carboxamide has a molecular weight of 266.43 g/mol, XLogP of 2.93, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N,3-dimethyl-N-(4-methylcyclohexyl)cyclohexane-1-carboxamide is sourced from PubChem (CID 64549415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).