2-amino-N-[[1-(dimethylamino)cyclohexyl]methyl]-3-methylpentanamide

C15H31N3O — CID 61248438

IUPAC2-amino-N-[[1-(dimethylamino)cyclohexyl]methyl]-3-methylpentanamide
SMILESCCC(C)C(N)C(=O)NCC1(N(C)C)CCCCC1
InChIInChI=1S/C15H31N3O/c1-5-12(2)13(16)14(19)17-11-15(18(3)4)9-7-6-8-10-15/h12-13H,5-11,16H2,1-4H3,(H,17,19)
InChIKeyNRZRAPQPEHSGTC-UHFFFAOYSA-N
MW269.43 g/mol
LogP1.74
Rot. Bonds6

About 2-amino-N-[[1-(dimethylamino)cyclohexyl]methyl]-3-methylpentanamide

2-amino-N-[[1-(dimethylamino)cyclohexyl]methyl]-3-methylpentanamide (PubChem CID 61248438) has the molecular formula C15H31N3O and a molecular weight of 269.43 g/mol. Its IUPAC name is 2-amino-N-[[1-(dimethylamino)cyclohexyl]methyl]-3-methylpentanamide.

Molecular Properties

Compound Name2-amino-N-[[1-(dimethylamino)cyclohexyl]methyl]-3-methylpentanamide
PubChem CID61248438
Molecular FormulaC15H31N3O
Molecular Weight269.43 g/mol
Exact Mass269.25
IUPAC Name2-amino-N-[[1-(dimethylamino)cyclohexyl]methyl]-3-methylpentanamide
SMILESCCC(C)C(N)C(=O)NCC1(N(C)C)CCCCC1
InChIInChI=1S/C15H31N3O/c1-5-12(2)13(16)14(19)17-11-15(18(3)4)9-7-6-8-10-15/h12-13H,5-11,16H2,1-4H3,(H,17,19)
InChIKeyNRZRAPQPEHSGTC-UHFFFAOYSA-N
XLogP1.74
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-amino-N-[[1-(dimethylamino)cyclohexyl]methyl]-3-methylpentanamide 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

(2S,3S)-2-amino-N-[[1-(dimethylamino)cyclobutyl]methyl]-3-methylpentanamide
CID 105417156
(2S)-2-amino-N-[[1-(dimethylamino)-3-methylcyclohexyl]methyl]-3-methylpentanamide
CID 61211747
(2S)-2-amino-N-[[1-(hydroxymethyl)cyclopentyl]methyl]-3-methylpentanamide
CID 113293910
3-amino-N-[[1-(dimethylamino)cyclobutyl]methyl]-2-methylbutanamide
CID 105417065
(2S)-2-amino-N-[(1-hydroxycyclobutyl)methyl]-3-methylpentanamide
CID 104874186
(2S)-2-amino-3-methyl-N-[(1-propylcyclopropyl)methyl]pentanamide
CID 103833324
N-[[1-(dimethylamino)cyclopentyl]methyl]-2-sulfanylpropanamide
CID 107034071
3-amino-N-[[1-(dimethylamino)cycloheptyl]methyl]butanamide
CID 119834021
(2S)-2-amino-3-methyl-N-[(1-propan-2-ylcyclopropyl)methyl]pentanamide
CID 103833263
N-[[1-(dimethylamino)cyclobutyl]methyl]-2-methoxypropanamide
CID 105420622
(2S)-2-amino-N-[[1-(dimethylamino)cyclohexyl]methyl]-2-phenylacetamide
CID 104897629
2-cyano-N-[[1-(dimethylamino)cyclopentyl]methyl]propanamide
CID 78996361

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[[1-(dimethylamino)cyclohexyl]methyl]-3-methylpentanamide?
The IUPAC name of 2-amino-N-[[1-(dimethylamino)cyclohexyl]methyl]-3-methylpentanamide (CID 61248438) is 2-amino-N-[[1-(dimethylamino)cyclohexyl]methyl]-3-methylpentanamide.
What is the SMILES notation for 2-amino-N-[[1-(dimethylamino)cyclohexyl]methyl]-3-methylpentanamide?
The canonical SMILES for 2-amino-N-[[1-(dimethylamino)cyclohexyl]methyl]-3-methylpentanamide is CCC(C)C(N)C(=O)NCC1(N(C)C)CCCCC1.
What is the InChIKey of 2-amino-N-[[1-(dimethylamino)cyclohexyl]methyl]-3-methylpentanamide?
The InChIKey is NRZRAPQPEHSGTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O/c1-5-12(2)13(16)14(19)17-11-15(18(3)4)9-7-6-8-10-15/h12-13H,5-11,16H2,1-4H3,(H,17,19).
What are the key properties of 2-amino-N-[[1-(dimethylamino)cyclohexyl]methyl]-3-methylpentanamide?
2-amino-N-[[1-(dimethylamino)cyclohexyl]methyl]-3-methylpentanamide has a molecular weight of 269.43 g/mol, XLogP of 1.74, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[[1-(dimethylamino)cyclohexyl]methyl]-3-methylpentanamide is sourced from PubChem (CID 61248438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).