4-amino-N-[2-[cyclopropyl(methyl)amino]propyl]pentanamide

C12H25N3O — CID 106813359

IUPAC4-amino-N-[2-[cyclopropyl(methyl)amino]propyl]pentanamide
SMILESCC(N)CCC(=O)NCC(C)N(C)C1CC1
InChIInChI=1S/C12H25N3O/c1-9(13)4-7-12(16)14-8-10(2)15(3)11-5-6-11/h9-11H,4-8,13H2,1-3H3,(H,14,16)
InChIKeyNKQBHHFIDNAJBQ-UHFFFAOYSA-N
MW227.35 g/mol
LogP0.71
Rot. Bonds7

About 4-amino-N-[2-[cyclopropyl(methyl)amino]propyl]pentanamide

4-amino-N-[2-[cyclopropyl(methyl)amino]propyl]pentanamide (PubChem CID 106813359) has the molecular formula C12H25N3O and a molecular weight of 227.35 g/mol. Its IUPAC name is 4-amino-N-[2-[cyclopropyl(methyl)amino]propyl]pentanamide.

Molecular Properties

Compound Name4-amino-N-[2-[cyclopropyl(methyl)amino]propyl]pentanamide
PubChem CID106813359
Molecular FormulaC12H25N3O
Molecular Weight227.35 g/mol
Exact Mass227.20
IUPAC Name4-amino-N-[2-[cyclopropyl(methyl)amino]propyl]pentanamide
SMILESCC(N)CCC(=O)NCC(C)N(C)C1CC1
InChIInChI=1S/C12H25N3O/c1-9(13)4-7-12(16)14-8-10(2)15(3)11-5-6-11/h9-11H,4-8,13H2,1-3H3,(H,14,16)
InChIKeyNKQBHHFIDNAJBQ-UHFFFAOYSA-N
XLogP0.71
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-amino-N-[2-[cyclopropyl(methyl)amino]propyl]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

4-amino-N-[2-[cyclopropyl(methyl)amino]propyl]butanamide;dihydrochloride
CID 119875597
N-[2-[cyclopropyl(methyl)amino]propyl]-5-hydroxypentanamide
CID 103895673
2-amino-N-[2-[2-[cyclopropyl(methyl)amino]propylamino]-2-oxoethyl]acetamide
CID 104872590
4-amino-N-[2-[cyclopropyl(methyl)amino]propyl]-3-methoxybutanamide
CID 107093488
2-(4-aminophenyl)-N-[2-[cyclopropyl(methyl)amino]propyl]acetamide
CID 103814364
2-(4-aminopiperidin-1-yl)-N-[2-[cyclopropyl(methyl)amino]propyl]acetamide
CID 103814367
1-[2-[cyclopropyl(methyl)amino]propyl]-3-(2-hydroxypentyl)urea
CID 111338463
2-[1-(aminomethyl)cyclohexyl]-N-[2-[cyclopropyl(methyl)amino]propyl]acetamide
CID 104844601
1-tert-butyl-3-[2-[cyclopropyl(methyl)amino]propyl]urea
CID 103752966
1-amino-N-[2-[cyclopropyl(methyl)amino]propyl]cyclohexane-1-carboxamide
CID 103814425
cis-(1R,3S)-3-[2-[cyclopropyl(methyl)amino]propylcarbamoyl]-2,2-dimethylcyclopropane-1-carboxylic acid
CID 114132555
2-amino-N-[2-[cyclopropyl(methyl)amino]propyl]cyclopentane-1-carboxamide;dihydrochloride
CID 119875547

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[2-[cyclopropyl(methyl)amino]propyl]pentanamide?
The IUPAC name of 4-amino-N-[2-[cyclopropyl(methyl)amino]propyl]pentanamide (CID 106813359) is 4-amino-N-[2-[cyclopropyl(methyl)amino]propyl]pentanamide.
What is the SMILES notation for 4-amino-N-[2-[cyclopropyl(methyl)amino]propyl]pentanamide?
The canonical SMILES for 4-amino-N-[2-[cyclopropyl(methyl)amino]propyl]pentanamide is CC(N)CCC(=O)NCC(C)N(C)C1CC1.
What is the InChIKey of 4-amino-N-[2-[cyclopropyl(methyl)amino]propyl]pentanamide?
The InChIKey is NKQBHHFIDNAJBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O/c1-9(13)4-7-12(16)14-8-10(2)15(3)11-5-6-11/h9-11H,4-8,13H2,1-3H3,(H,14,16).
What are the key properties of 4-amino-N-[2-[cyclopropyl(methyl)amino]propyl]pentanamide?
4-amino-N-[2-[cyclopropyl(methyl)amino]propyl]pentanamide has a molecular weight of 227.35 g/mol, XLogP of 0.71, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[2-[cyclopropyl(methyl)amino]propyl]pentanamide is sourced from PubChem (CID 106813359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).