2-(aminomethyl)-N,4,4-trimethyl-N-(4-methylpentan-2-yl)pentanamide

C15H32N2O — CID 107471541

IUPAC2-(aminomethyl)-N,4,4-trimethyl-N-(4-methylpentan-2-yl)pentanamide
SMILESCC(C)CC(C)N(C)C(=O)C(CN)CC(C)(C)C
InChIInChI=1S/C15H32N2O/c1-11(2)8-12(3)17(7)14(18)13(10-16)9-15(4,5)6/h11-13H,8-10,16H2,1-7H3
InChIKeyDSNYEAGVJNAODZ-UHFFFAOYSA-N
MW256.43 g/mol
LogP2.89
Rot. Bonds6

About 2-(aminomethyl)-N,4,4-trimethyl-N-(4-methylpentan-2-yl)pentanamide

2-(aminomethyl)-N,4,4-trimethyl-N-(4-methylpentan-2-yl)pentanamide (PubChem CID 107471541) has the molecular formula C15H32N2O and a molecular weight of 256.43 g/mol. Its IUPAC name is 2-(aminomethyl)-N,4,4-trimethyl-N-(4-methylpentan-2-yl)pentanamide.

Molecular Properties

Compound Name2-(aminomethyl)-N,4,4-trimethyl-N-(4-methylpentan-2-yl)pentanamide
PubChem CID107471541
Molecular FormulaC15H32N2O
Molecular Weight256.43 g/mol
Exact Mass256.25
IUPAC Name2-(aminomethyl)-N,4,4-trimethyl-N-(4-methylpentan-2-yl)pentanamide
SMILESCC(C)CC(C)N(C)C(=O)C(CN)CC(C)(C)C
InChIInChI=1S/C15H32N2O/c1-11(2)8-12(3)17(7)14(18)13(10-16)9-15(4,5)6/h11-13H,8-10,16H2,1-7H3
InChIKeyDSNYEAGVJNAODZ-UHFFFAOYSA-N
XLogP2.89
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.43
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(aminomethyl)-N,4,4-trimethyl-N-(4-methylpentan-2-yl)pentanamide 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

N,2-dimethyl-N-[(2R)-4-methylpentan-2-yl]propanamide
CID 153298886
2-(aminomethyl)-N-butyl-N,4,4-trimethylpentanamide
CID 107470989
2-(aminomethyl)-N-[2-(dimethylamino)ethyl]-4,4-dimethyl-N-(2-methylpropyl)pentanamide
CID 107471656
2-amino-N-methyl-N-(4-methylpentan-2-yl)butanediamide
CID 60939070
2-(aminomethyl)-N,N-dibutyl-4,4-dimethylpentanamide
CID 107471112
3-amino-N,2,2,3-tetramethyl-N-(4-methylpentan-2-yl)butanamide
CID 65269995
4-amino-N,3-dimethyl-N-(4-methylpentan-2-yl)butanamide
CID 81086981
(2S)-2-amino-N-methyl-N-(4-methylpentan-2-yl)-4-methylsulfanylbutanamide
CID 61165244
2-(aminomethyl)-N-ethyl-N-(3-hydroxypropyl)-4,4-dimethylpentanamide
CID 107472719
2-(aminomethyl)-N-(cyclopropylmethyl)-N,4,4-trimethylpentanamide
CID 107471602
(2S)-2-amino-N-(1-hydroxypropan-2-yl)-N,4-dimethylpentanamide
CID 104551700
2-(aminomethyl)-N-(2-methoxyethyl)-4,4-dimethyl-N-propan-2-ylpentanamide
CID 107472614

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N,4,4-trimethyl-N-(4-methylpentan-2-yl)pentanamide?
The IUPAC name of 2-(aminomethyl)-N,4,4-trimethyl-N-(4-methylpentan-2-yl)pentanamide (CID 107471541) is 2-(aminomethyl)-N,4,4-trimethyl-N-(4-methylpentan-2-yl)pentanamide.
What is the SMILES notation for 2-(aminomethyl)-N,4,4-trimethyl-N-(4-methylpentan-2-yl)pentanamide?
The canonical SMILES for 2-(aminomethyl)-N,4,4-trimethyl-N-(4-methylpentan-2-yl)pentanamide is CC(C)CC(C)N(C)C(=O)C(CN)CC(C)(C)C.
What is the InChIKey of 2-(aminomethyl)-N,4,4-trimethyl-N-(4-methylpentan-2-yl)pentanamide?
The InChIKey is DSNYEAGVJNAODZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O/c1-11(2)8-12(3)17(7)14(18)13(10-16)9-15(4,5)6/h11-13H,8-10,16H2,1-7H3.
What are the key properties of 2-(aminomethyl)-N,4,4-trimethyl-N-(4-methylpentan-2-yl)pentanamide?
2-(aminomethyl)-N,4,4-trimethyl-N-(4-methylpentan-2-yl)pentanamide has a molecular weight of 256.43 g/mol, XLogP of 2.89, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N,4,4-trimethyl-N-(4-methylpentan-2-yl)pentanamide is sourced from PubChem (CID 107471541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).