5-[(2-cyclopropylphenyl)methylamino]pentanamide

C15H22N2O — CID 106234312

IUPAC5-[(2-cyclopropylphenyl)methylamino]pentanamide
SMILESNC(=O)CCCCNCc1ccccc1C1CC1
InChIInChI=1S/C15H22N2O/c16-15(18)7-3-4-10-17-11-13-5-1-2-6-14(13)12-8-9-12/h1-2,5-6,12,17H,3-4,7-11H2,(H2,16,18)
InChIKeyNNXGQGGGYRZAHD-UHFFFAOYSA-N
MW246.35 g/mol
LogP2.31
Rot. Bonds8

About 5-[(2-cyclopropylphenyl)methylamino]pentanamide

5-[(2-cyclopropylphenyl)methylamino]pentanamide (PubChem CID 106234312) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is 5-[(2-cyclopropylphenyl)methylamino]pentanamide.

Molecular Properties

Compound Name5-[(2-cyclopropylphenyl)methylamino]pentanamide
PubChem CID106234312
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name5-[(2-cyclopropylphenyl)methylamino]pentanamide
SMILESNC(=O)CCCCNCc1ccccc1C1CC1
InChIInChI=1S/C15H22N2O/c16-15(18)7-3-4-10-17-11-13-5-1-2-6-14(13)12-8-9-12/h1-2,5-6,12,17H,3-4,7-11H2,(H2,16,18)
InChIKeyNNXGQGGGYRZAHD-UHFFFAOYSA-N
XLogP2.31
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 5-[(2-cyclopropylphenyl)methylamino]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-cyclopropylphenyl)methyl]propane-1,3-diamine
CID 79979438
N-[(2-cyclopropylphenyl)methyl]-5,5,5-trifluoropentan-1-amine
CID 115491475
N-[(2-cyclopropylphenyl)methyl]-3-methylsulfonylpropan-1-amine
CID 79889051
3-[(2-cyclopropylphenyl)methylamino]-2-hydroxypropanamide
CID 114153579
2-[(2-cyclopropylphenyl)methylamino]acetic acid
CID 79979274
N-[3-[(2-cyclopropylphenyl)methylamino]propyl]methanesulfonamide
CID 103739279
methyl 2-[(2-cyclopropylphenyl)methylamino]acetate
CID 79978808
2-(2-cyclopentylphenyl)acetamide
CID 68862878
4-[(2,3-dihydroxyphenyl)methylamino]butanamide
CID 61319309
4-[(2-methoxyphenyl)methylamino]butanamide
CID 60863188
1-[(2-cyclopropylphenyl)methylamino]-2-methylpropan-2-ol
CID 79888885
5-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethylamino)pentanamide
CID 106234592

Frequently Asked Questions

What is the IUPAC name of 5-[(2-cyclopropylphenyl)methylamino]pentanamide?
The IUPAC name of 5-[(2-cyclopropylphenyl)methylamino]pentanamide (CID 106234312) is 5-[(2-cyclopropylphenyl)methylamino]pentanamide.
What is the SMILES notation for 5-[(2-cyclopropylphenyl)methylamino]pentanamide?
The canonical SMILES for 5-[(2-cyclopropylphenyl)methylamino]pentanamide is NC(=O)CCCCNCc1ccccc1C1CC1.
What is the InChIKey of 5-[(2-cyclopropylphenyl)methylamino]pentanamide?
The InChIKey is NNXGQGGGYRZAHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c16-15(18)7-3-4-10-17-11-13-5-1-2-6-14(13)12-8-9-12/h1-2,5-6,12,17H,3-4,7-11H2,(H2,16,18).
What are the key properties of 5-[(2-cyclopropylphenyl)methylamino]pentanamide?
5-[(2-cyclopropylphenyl)methylamino]pentanamide has a molecular weight of 246.35 g/mol, XLogP of 2.31, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-cyclopropylphenyl)methylamino]pentanamide is sourced from PubChem (CID 106234312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).