4-amino-3-methyl-N-propan-2-ylcyclohexane-1-carboxamide

C11H22N2O — CID 62777735

IUPAC4-amino-3-methyl-N-propan-2-ylcyclohexane-1-carboxamide
SMILESCC(C)NC(=O)C1CCC(N)C(C)C1
InChIInChI=1S/C11H22N2O/c1-7(2)13-11(14)9-4-5-10(12)8(3)6-9/h7-10H,4-6,12H2,1-3H3,(H,13,14)
InChIKeyRSUMQTFTCFVYIU-UHFFFAOYSA-N
MW198.31 g/mol
LogP1.27
Rot. Bonds2

About 4-amino-3-methyl-N-propan-2-ylcyclohexane-1-carboxamide

4-amino-3-methyl-N-propan-2-ylcyclohexane-1-carboxamide (PubChem CID 62777735) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 4-amino-3-methyl-N-propan-2-ylcyclohexane-1-carboxamide.

Molecular Properties

Compound Name4-amino-3-methyl-N-propan-2-ylcyclohexane-1-carboxamide
PubChem CID62777735
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name4-amino-3-methyl-N-propan-2-ylcyclohexane-1-carboxamide
SMILESCC(C)NC(=O)C1CCC(N)C(C)C1
InChIInChI=1S/C11H22N2O/c1-7(2)13-11(14)9-4-5-10(12)8(3)6-9/h7-10H,4-6,12H2,1-3H3,(H,13,14)
InChIKeyRSUMQTFTCFVYIU-UHFFFAOYSA-N
XLogP1.27
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-amino-N-(1-cyclohexylethyl)-3-methylcyclohexane-1-carboxamide
CID 55116861
4-amino-N-(3-ethylpentan-2-yl)-3-methylcyclohexane-1-carboxamide
CID 63840862
4-amino-3-methyl-N-(2-methylpentan-3-yl)cyclohexane-1-carboxamide
CID 62783259
4-amino-N-[4-(dimethylamino)butan-2-yl]-3-methylcyclohexane-1-carboxamide
CID 55115402
4-amino-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-3-methylcyclohexane-1-carboxamide
CID 103113502
4-amino-N-[1-(dimethylamino)-4-methylpentan-2-yl]-3-methylcyclohexane-1-carboxamide
CID 62782597
4-amino-N-[2-(dimethylamino)propyl]-3-methylcyclohexane-1-carboxamide
CID 62782736
4-amino-N-(3,5-dimethylcyclohexyl)-3-methylcyclohexane-1-carboxamide
CID 64733535
4-amino-N-(2,6-dimethylpiperidin-1-yl)-3-methylcyclohexane-1-carboxamide
CID 83024704
4-amino-3-methyl-N-(2-propan-2-yloxyethyl)cyclohexane-1-carboxamide
CID 104766026
4-amino-N-ethyl-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclohexane-1-carboxamide
CID 62783394
2-amino-5-methyl-N-propan-2-ylcyclohexane-1-carboxamide
CID 65455850

Frequently Asked Questions

What is the IUPAC name of 4-amino-3-methyl-N-propan-2-ylcyclohexane-1-carboxamide?
The IUPAC name of 4-amino-3-methyl-N-propan-2-ylcyclohexane-1-carboxamide (CID 62777735) is 4-amino-3-methyl-N-propan-2-ylcyclohexane-1-carboxamide.
What is the SMILES notation for 4-amino-3-methyl-N-propan-2-ylcyclohexane-1-carboxamide?
The canonical SMILES for 4-amino-3-methyl-N-propan-2-ylcyclohexane-1-carboxamide is CC(C)NC(=O)C1CCC(N)C(C)C1.
What is the InChIKey of 4-amino-3-methyl-N-propan-2-ylcyclohexane-1-carboxamide?
The InChIKey is RSUMQTFTCFVYIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-7(2)13-11(14)9-4-5-10(12)8(3)6-9/h7-10H,4-6,12H2,1-3H3,(H,13,14).
What are the key properties of 4-amino-3-methyl-N-propan-2-ylcyclohexane-1-carboxamide?
4-amino-3-methyl-N-propan-2-ylcyclohexane-1-carboxamide has a molecular weight of 198.31 g/mol, XLogP of 1.27, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-3-methyl-N-propan-2-ylcyclohexane-1-carboxamide is sourced from PubChem (CID 62777735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).