2-(aminomethyl)-N-(1-cyclohexylpropyl)-3-methylbutanamide

C15H30N2O — CID 62406666

IUPAC2-(aminomethyl)-N-(1-cyclohexylpropyl)-3-methylbutanamide
SMILESCCC(NC(=O)C(CN)C(C)C)C1CCCCC1
InChIInChI=1S/C15H30N2O/c1-4-14(12-8-6-5-7-9-12)17-15(18)13(10-16)11(2)3/h11-14H,4-10,16H2,1-3H3,(H,17,18)
InChIKeyLYSCRMYFGHEVIY-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.69
Rot. Bonds6

About 2-(aminomethyl)-N-(1-cyclohexylpropyl)-3-methylbutanamide

2-(aminomethyl)-N-(1-cyclohexylpropyl)-3-methylbutanamide (PubChem CID 62406666) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 2-(aminomethyl)-N-(1-cyclohexylpropyl)-3-methylbutanamide.

Molecular Properties

Compound Name2-(aminomethyl)-N-(1-cyclohexylpropyl)-3-methylbutanamide
PubChem CID62406666
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name2-(aminomethyl)-N-(1-cyclohexylpropyl)-3-methylbutanamide
SMILESCCC(NC(=O)C(CN)C(C)C)C1CCCCC1
InChIInChI=1S/C15H30N2O/c1-4-14(12-8-6-5-7-9-12)17-15(18)13(10-16)11(2)3/h11-14H,4-10,16H2,1-3H3,(H,17,18)
InChIKeyLYSCRMYFGHEVIY-UHFFFAOYSA-N
XLogP2.69
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(aminomethyl)-N-(1-cyclohexylpropyl)-3-methylbutanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-bromo-N-(1-cyclohexylpropyl)propanamide
CID 107905149
N-(1-cyclohexylpropyl)-2-(N'-hydroxycarbamimidoyl)-3-methylbutanamide
CID 76943287
N-(1-cyclohexylpropyl)acetamide
CID 45119320
N-(2-amino-1-cyclohexylethyl)-2-(dimethylamino)-3-methylbutanamide;dihydrochloride
CID 119590156
2-(1-cyclohexylpropylcarbamoylamino)-3-methylbutanoic acid
CID 62406363
(2S)-2-amino-N-(1-cyclohexylpropyl)-4-methylsulfanylbutanamide
CID 62406341
N-(2-amino-1-cyclohexylethyl)-2-ethylhexanamide
CID 81486044
2-chloro-N-(1-cyclohexylpropyl)acetamide
CID 62407197
2-(aminomethyl)-N-(1-cyclohexylethyl)butanamide
CID 62405592
2-amino-N-(1-cyclohexylpropyl)-3,3,3-trifluoro-2-methylpropanamide
CID 79811328
2-amino-N-(1-cyclohexylpropyl)-5-methoxypentanamide
CID 81088329
1-cyclohexylpropylthiourea
CID 62407553

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-(1-cyclohexylpropyl)-3-methylbutanamide?
The IUPAC name of 2-(aminomethyl)-N-(1-cyclohexylpropyl)-3-methylbutanamide (CID 62406666) is 2-(aminomethyl)-N-(1-cyclohexylpropyl)-3-methylbutanamide.
What is the SMILES notation for 2-(aminomethyl)-N-(1-cyclohexylpropyl)-3-methylbutanamide?
The canonical SMILES for 2-(aminomethyl)-N-(1-cyclohexylpropyl)-3-methylbutanamide is CCC(NC(=O)C(CN)C(C)C)C1CCCCC1.
What is the InChIKey of 2-(aminomethyl)-N-(1-cyclohexylpropyl)-3-methylbutanamide?
The InChIKey is LYSCRMYFGHEVIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-4-14(12-8-6-5-7-9-12)17-15(18)13(10-16)11(2)3/h11-14H,4-10,16H2,1-3H3,(H,17,18).
What are the key properties of 2-(aminomethyl)-N-(1-cyclohexylpropyl)-3-methylbutanamide?
2-(aminomethyl)-N-(1-cyclohexylpropyl)-3-methylbutanamide has a molecular weight of 254.42 g/mol, XLogP of 2.69, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-(1-cyclohexylpropyl)-3-methylbutanamide is sourced from PubChem (CID 62406666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).