4-amino-3-methyl-N-(3-methylcyclohexyl)butanamide

C12H24N2O — CID 81071155

IUPAC4-amino-3-methyl-N-(3-methylcyclohexyl)butanamide
SMILESCC(CN)CC(=O)NC1CCCC(C)C1
InChIInChI=1S/C12H24N2O/c1-9-4-3-5-11(6-9)14-12(15)7-10(2)8-13/h9-11H,3-8,13H2,1-2H3,(H,14,15)
InChIKeyDIBGTTVTZSCSCD-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.67
Rot. Bonds4

About 4-amino-3-methyl-N-(3-methylcyclohexyl)butanamide

4-amino-3-methyl-N-(3-methylcyclohexyl)butanamide (PubChem CID 81071155) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 4-amino-3-methyl-N-(3-methylcyclohexyl)butanamide.

Molecular Properties

Compound Name4-amino-3-methyl-N-(3-methylcyclohexyl)butanamide
PubChem CID81071155
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name4-amino-3-methyl-N-(3-methylcyclohexyl)butanamide
SMILESCC(CN)CC(=O)NC1CCCC(C)C1
InChIInChI=1S/C12H24N2O/c1-9-4-3-5-11(6-9)14-12(15)7-10(2)8-13/h9-11H,3-8,13H2,1-2H3,(H,14,15)
InChIKeyDIBGTTVTZSCSCD-UHFFFAOYSA-N
XLogP1.67
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-amino-N-cyclobutyl-3-methylbutanamide
CID 81086885
4-amino-N-cyclohexyl-3-methylbutanamide
CID 81070976
4-amino-3-methyl-N-[3-(trifluoromethyl)cyclohexyl]butanamide
CID 81076103
3-methyl-N-(3-methylcyclopentyl)pentanamide
CID 114875354
3-amino-N-(3-methylcyclopentyl)butanamide
CID 114546157
3-[(3-methylcyclohexyl)amino]-3-oxopropanoic acid
CID 62229888
5-(cyclobutylamino)-3-methyl-5-oxopentanoic acid
CID 62965613
2-methyl-N-(3-methylcyclohexyl)propanamide
CID 60739958
7-amino-N-(3-methylcyclohexyl)heptanamide
CID 43317968
3-(3-methylpentanoylamino)cyclohexane-1-carboxylic acid
CID 114873705
5-amino-N-(3-hydroxycyclohexyl)-4-methylpentanamide
CID 82012457
N-(3-methylcyclohexyl)-4-(propan-2-ylamino)butanamide
CID 60850780

Frequently Asked Questions

What is the IUPAC name of 4-amino-3-methyl-N-(3-methylcyclohexyl)butanamide?
The IUPAC name of 4-amino-3-methyl-N-(3-methylcyclohexyl)butanamide (CID 81071155) is 4-amino-3-methyl-N-(3-methylcyclohexyl)butanamide.
What is the SMILES notation for 4-amino-3-methyl-N-(3-methylcyclohexyl)butanamide?
The canonical SMILES for 4-amino-3-methyl-N-(3-methylcyclohexyl)butanamide is CC(CN)CC(=O)NC1CCCC(C)C1.
What is the InChIKey of 4-amino-3-methyl-N-(3-methylcyclohexyl)butanamide?
The InChIKey is DIBGTTVTZSCSCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-9-4-3-5-11(6-9)14-12(15)7-10(2)8-13/h9-11H,3-8,13H2,1-2H3,(H,14,15).
What are the key properties of 4-amino-3-methyl-N-(3-methylcyclohexyl)butanamide?
4-amino-3-methyl-N-(3-methylcyclohexyl)butanamide has a molecular weight of 212.34 g/mol, XLogP of 1.67, 4 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-(3-methylcyclohexyl)butanamide is sourced from PubChem (CID 81071155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).