4-amino-N-[3-(4-methoxyphenyl)propyl]pentanamide

C15H24N2O2 — CID 120560980

IUPAC4-amino-N-[3-(4-methoxyphenyl)propyl]pentanamide
SMILESCOc1ccc(CCCNC(=O)CCC(C)N)cc1
InChIInChI=1S/C15H24N2O2/c1-12(16)5-10-15(18)17-11-3-4-13-6-8-14(19-2)9-7-13/h6-9,12H,3-5,10-11,16H2,1-2H3,(H,17,18)
InChIKeyFZBZMMKKSZAPMX-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.87
Rot. Bonds8

About 4-amino-N-[3-(4-methoxyphenyl)propyl]pentanamide

4-amino-N-[3-(4-methoxyphenyl)propyl]pentanamide (PubChem CID 120560980) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 4-amino-N-[3-(4-methoxyphenyl)propyl]pentanamide.

Molecular Properties

Compound Name4-amino-N-[3-(4-methoxyphenyl)propyl]pentanamide
PubChem CID120560980
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name4-amino-N-[3-(4-methoxyphenyl)propyl]pentanamide
SMILESCOc1ccc(CCCNC(=O)CCC(C)N)cc1
InChIInChI=1S/C15H24N2O2/c1-12(16)5-10-15(18)17-11-3-4-13-6-8-14(19-2)9-7-13/h6-9,12H,3-5,10-11,16H2,1-2H3,(H,17,18)
InChIKeyFZBZMMKKSZAPMX-UHFFFAOYSA-N
XLogP1.87
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(3-aminobutyl)-6-(4-methoxyphenyl)hexanamide;hydrochloride
CID 119496458
N-(3-aminobutyl)-3-(4-methoxyphenyl)propanamide;hydrochloride
CID 119498019
2-amino-N-[3-(4-methoxyphenyl)propyl]acetamide
CID 119299625
5-(4-methoxyphenyl)-N-(3-methylbutyl)pentanamide
CID 110297852
N-(5-amino-4-methylpentyl)-3-(4-methoxyphenyl)propanamide
CID 106153300
3-(4-methoxyphenyl)-N-[8-[3-(4-methoxyphenyl)propanoylamino]octyl]propanamide
CID 4661025
5-[3-(4-methoxyphenyl)propanoylamino]-2-methylpentanoic acid
CID 104682662
N-[3-(4-methoxyphenyl)propyl]-3-methylsulfonylpropanamide
CID 110627872
1-[3-(4-methoxyphenyl)propyl]-3-(3-methylbutyl)urea
CID 110307723
N-(3-aminopropyl)-6-(4-methoxyphenyl)hexanamide;hydrochloride
CID 119406247
N-[3-(4-methoxyphenyl)propyl]-3-[(2-phenylacetyl)amino]propanamide
CID 55919627
2-(3-aminobutylsulfanyl)-N-[2-(4-methoxyphenyl)ethyl]acetamide
CID 66233283

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[3-(4-methoxyphenyl)propyl]pentanamide?
The IUPAC name of 4-amino-N-[3-(4-methoxyphenyl)propyl]pentanamide (CID 120560980) is 4-amino-N-[3-(4-methoxyphenyl)propyl]pentanamide.
What is the SMILES notation for 4-amino-N-[3-(4-methoxyphenyl)propyl]pentanamide?
The canonical SMILES for 4-amino-N-[3-(4-methoxyphenyl)propyl]pentanamide is COc1ccc(CCCNC(=O)CCC(C)N)cc1.
What is the InChIKey of 4-amino-N-[3-(4-methoxyphenyl)propyl]pentanamide?
The InChIKey is FZBZMMKKSZAPMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-12(16)5-10-15(18)17-11-3-4-13-6-8-14(19-2)9-7-13/h6-9,12H,3-5,10-11,16H2,1-2H3,(H,17,18).
What are the key properties of 4-amino-N-[3-(4-methoxyphenyl)propyl]pentanamide?
4-amino-N-[3-(4-methoxyphenyl)propyl]pentanamide has a molecular weight of 264.37 g/mol, XLogP of 1.87, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[3-(4-methoxyphenyl)propyl]pentanamide is sourced from PubChem (CID 120560980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).