2-[3-aminopropyl(cyclopropyl)amino]-N-(2-methylphenyl)acetamide

C15H23N3O — CID 43319569

IUPAC2-[3-aminopropyl(cyclopropyl)amino]-N-(2-methylphenyl)acetamide
SMILESCc1ccccc1NC(=O)CN(CCCN)C1CC1
InChIInChI=1S/C15H23N3O/c1-12-5-2-3-6-14(12)17-15(19)11-18(10-4-9-16)13-7-8-13/h2-3,5-6,13H,4,7-11,16H2,1H3,(H,17,19)
InChIKeySMKNOWLVMKWCPF-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.75
Rot. Bonds7

About 2-[3-aminopropyl(cyclopropyl)amino]-N-(2-methylphenyl)acetamide

2-[3-aminopropyl(cyclopropyl)amino]-N-(2-methylphenyl)acetamide (PubChem CID 43319569) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 2-[3-aminopropyl(cyclopropyl)amino]-N-(2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-[3-aminopropyl(cyclopropyl)amino]-N-(2-methylphenyl)acetamide
PubChem CID43319569
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name2-[3-aminopropyl(cyclopropyl)amino]-N-(2-methylphenyl)acetamide
SMILESCc1ccccc1NC(=O)CN(CCCN)C1CC1
InChIInChI=1S/C15H23N3O/c1-12-5-2-3-6-14(12)17-15(19)11-18(10-4-9-16)13-7-8-13/h2-3,5-6,13H,4,7-11,16H2,1H3,(H,17,19)
InChIKeySMKNOWLVMKWCPF-UHFFFAOYSA-N
XLogP1.75
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[3-aminopropyl(cyclopropyl)amino]-N-(2-methylphenyl)acetamide 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

ethyl 2-[cyclopropyl-[2-(2-methylanilino)-2-oxoethyl]amino]acetate
CID 47545412
2-[cyclopropyl(4-hydroxybutyl)amino]-N-(2-fluorophenyl)acetamide
CID 111457011
2-[ethyl(piperidin-4-yl)amino]-N-(2-methylphenyl)acetamide
CID 60805607
2-[butyl(cyclopropyl)amino]-N-(2-carbamothioylphenyl)acetamide
CID 61441785
2-[cycloheptyl(methyl)amino]-N-(2-methylphenyl)acetamide
CID 16577693
2-[methyl-[4-(methylamino)cyclohexyl]amino]-N-(2-methylphenyl)acetamide
CID 79117144
2-[cyclopentyl(2-hydroxyethyl)amino]-N-(2,3-dimethylphenyl)acetamide
CID 60911691
3-[cyclopropyl-[2-(2,5-dimethylanilino)-2-oxoethyl]amino]-N-(2,3-dimethylphenyl)propanamide
CID 84567732
3-[cyclopropyl-[2-(2,5-dimethylanilino)-2-oxoethyl]amino]-N-(2,5-dimethylphenyl)propanamide
CID 84567734
N-(5-chloro-2-methylphenyl)-3-[cyclopropyl-[2-(2,6-dimethylanilino)-2-oxoethyl]amino]propanamide
CID 84566712
7-amino-N-(2-methylphenyl)heptanamide;hydrochloride
CID 119670447
3-[cyclopropyl-[2-(2,6-dimethylanilino)-2-oxoethyl]amino]-N-(2,4-dimethylphenyl)propanamide
CID 84567311

Frequently Asked Questions

What is the IUPAC name of 2-[3-aminopropyl(cyclopropyl)amino]-N-(2-methylphenyl)acetamide?
The IUPAC name of 2-[3-aminopropyl(cyclopropyl)amino]-N-(2-methylphenyl)acetamide (CID 43319569) is 2-[3-aminopropyl(cyclopropyl)amino]-N-(2-methylphenyl)acetamide.
What is the SMILES notation for 2-[3-aminopropyl(cyclopropyl)amino]-N-(2-methylphenyl)acetamide?
The canonical SMILES for 2-[3-aminopropyl(cyclopropyl)amino]-N-(2-methylphenyl)acetamide is Cc1ccccc1NC(=O)CN(CCCN)C1CC1.
What is the InChIKey of 2-[3-aminopropyl(cyclopropyl)amino]-N-(2-methylphenyl)acetamide?
The InChIKey is SMKNOWLVMKWCPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-12-5-2-3-6-14(12)17-15(19)11-18(10-4-9-16)13-7-8-13/h2-3,5-6,13H,4,7-11,16H2,1H3,(H,17,19).
What are the key properties of 2-[3-aminopropyl(cyclopropyl)amino]-N-(2-methylphenyl)acetamide?
2-[3-aminopropyl(cyclopropyl)amino]-N-(2-methylphenyl)acetamide has a molecular weight of 261.37 g/mol, XLogP of 1.75, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-aminopropyl(cyclopropyl)amino]-N-(2-methylphenyl)acetamide is sourced from PubChem (CID 43319569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).