N-(2-amino-3-cyclopropylphenyl)pentanamide

C14H20N2O — CID 170568889

IUPACN-(2-amino-3-cyclopropylphenyl)pentanamide
SMILESCCCCC(=O)Nc1cccc(C2CC2)c1N
InChIInChI=1S/C14H20N2O/c1-2-3-7-13(17)16-12-6-4-5-11(14(12)15)10-8-9-10/h4-6,10H,2-3,7-9,15H2,1H3,(H,16,17)
InChIKeyQYJLDPIRXKYSDM-UHFFFAOYSA-N
MW232.33 g/mol
LogP3.27
Rot. Bonds5

About N-(2-amino-3-cyclopropylphenyl)pentanamide

N-(2-amino-3-cyclopropylphenyl)pentanamide (PubChem CID 170568889) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is N-(2-amino-3-cyclopropylphenyl)pentanamide.

Molecular Properties

Compound NameN-(2-amino-3-cyclopropylphenyl)pentanamide
PubChem CID170568889
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC NameN-(2-amino-3-cyclopropylphenyl)pentanamide
SMILESCCCCC(=O)Nc1cccc(C2CC2)c1N
InChIInChI=1S/C14H20N2O/c1-2-3-7-13(17)16-12-6-4-5-11(14(12)15)10-8-9-10/h4-6,10H,2-3,7-9,15H2,1H3,(H,16,17)
InChIKeyQYJLDPIRXKYSDM-UHFFFAOYSA-N
XLogP3.27
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(3-hydroxy-2-methylphenyl)pentanamide
CID 64792889
N-(2-aminophenyl)octadecanamide
CID 68839220
N-(2-methyl-3-sulfanylphenyl)pentanamide
CID 4713033
N-(2-methyl-1,2,3,4-tetrahydroquinolin-8-yl)octanamide
CID 62952574
N-[6-(2-ethylanilino)pyridazin-3-yl]pentanamide
CID 113046636
N-naphthalen-1-yldodecanamide
CID 588517
2-chloro-6-(pentanoylamino)benzoic acid
CID 55231346
N-(2-aminophenyl)-3-[butyl(cyclopropyl)amino]propanamide
CID 61440644
2,6-dicyclopropylaniline
CID 129249080
N-(3-hydroxy-2-methylphenyl)decanamide
CID 65426726
N-(2,3-dimethylphenyl)dodecanamide
CID 4198682
N-(3-amino-2-methylphenyl)-4-propoxybutanamide
CID 43247848

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-3-cyclopropylphenyl)pentanamide?
The IUPAC name of N-(2-amino-3-cyclopropylphenyl)pentanamide (CID 170568889) is N-(2-amino-3-cyclopropylphenyl)pentanamide.
What is the SMILES notation for N-(2-amino-3-cyclopropylphenyl)pentanamide?
The canonical SMILES for N-(2-amino-3-cyclopropylphenyl)pentanamide is CCCCC(=O)Nc1cccc(C2CC2)c1N.
What is the InChIKey of N-(2-amino-3-cyclopropylphenyl)pentanamide?
The InChIKey is QYJLDPIRXKYSDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-2-3-7-13(17)16-12-6-4-5-11(14(12)15)10-8-9-10/h4-6,10H,2-3,7-9,15H2,1H3,(H,16,17).
What are the key properties of N-(2-amino-3-cyclopropylphenyl)pentanamide?
N-(2-amino-3-cyclopropylphenyl)pentanamide has a molecular weight of 232.33 g/mol, XLogP of 3.27, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-3-cyclopropylphenyl)pentanamide is sourced from PubChem (CID 170568889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).