2-amino-N-(2,5-dimethoxyphenyl)pentanamide;hydrochloride

C13H21ClN2O3 — CID 119263329

IUPAC2-amino-N-(2,5-dimethoxyphenyl)pentanamide;hydrochloride
SMILESCCCC(N)C(=O)Nc1cc(OC)ccc1OC.Cl
InChIInChI=1S/C13H20N2O3.ClH/c1-4-5-10(14)13(16)15-11-8-9(17-2)6-7-12(11)18-3;/h6-8,10H,4-5,14H2,1-3H3,(H,15,16);1H
InChIKeyJRCIBRAPPARQNV-UHFFFAOYSA-N
MW288.78 g/mol
LogP2.19
Rot. Bonds6

About 2-amino-N-(2,5-dimethoxyphenyl)pentanamide;hydrochloride

2-amino-N-(2,5-dimethoxyphenyl)pentanamide;hydrochloride (PubChem CID 119263329) has the molecular formula C13H21ClN2O3 and a molecular weight of 288.78 g/mol. Its IUPAC name is 2-amino-N-(2,5-dimethoxyphenyl)pentanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-(2,5-dimethoxyphenyl)pentanamide;hydrochloride
PubChem CID119263329
Molecular FormulaC13H21ClN2O3
Molecular Weight288.78 g/mol
Exact Mass288.12
IUPAC Name2-amino-N-(2,5-dimethoxyphenyl)pentanamide;hydrochloride
SMILESCCCC(N)C(=O)Nc1cc(OC)ccc1OC.Cl
InChIInChI=1S/C13H20N2O3.ClH/c1-4-5-10(14)13(16)15-11-8-9(17-2)6-7-12(11)18-3;/h6-8,10H,4-5,14H2,1-3H3,(H,15,16);1H
InChIKeyJRCIBRAPPARQNV-UHFFFAOYSA-N
XLogP2.19
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.78
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-(5-methoxy-2-propan-2-yloxyphenyl)pentanamide;hydrochloride
CID 119318030
(2S)-2-amino-N-(2-hydroxy-5-methoxyphenyl)pentanamide
CID 107570852
(2S)-2-amino-N-(2-chloro-5-methoxyphenyl)pentanamide
CID 107569473
(2R)-2-amino-N-(2-bromo-5-methoxyphenyl)pentanamide
CID 113264050
(2R)-2-amino-N-(2,5-diethoxyphenyl)pentanamide
CID 103794070
2-amino-N-(2,5-dimethoxyphenyl)-3,3-dimethylbutanamide
CID 76892238
2-amino-N-(2-bromo-4,5-dimethoxyphenyl)pentanamide;hydrochloride
CID 119301241
(2S)-2-amino-N-(4-chloro-2,5-dimethoxyphenyl)pentanamide
CID 107567961
N-[4-(2-aminopentanoylamino)-2,5-dimethoxyphenyl]benzamide
CID 119265950
3-[[(2S)-2-aminohexanoyl]amino]-4-methoxybenzamide
CID 103831255
N-(5-acetamido-2-methoxyphenyl)-2-aminohexanamide
CID 60853865
3-[[(2S)-2-aminohexanoyl]amino]-4-methoxybenzoic acid
CID 107145552

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2,5-dimethoxyphenyl)pentanamide;hydrochloride?
The IUPAC name of 2-amino-N-(2,5-dimethoxyphenyl)pentanamide;hydrochloride (CID 119263329) is 2-amino-N-(2,5-dimethoxyphenyl)pentanamide;hydrochloride.
What is the SMILES notation for 2-amino-N-(2,5-dimethoxyphenyl)pentanamide;hydrochloride?
The canonical SMILES for 2-amino-N-(2,5-dimethoxyphenyl)pentanamide;hydrochloride is CCCC(N)C(=O)Nc1cc(OC)ccc1OC.Cl.
What is the InChIKey of 2-amino-N-(2,5-dimethoxyphenyl)pentanamide;hydrochloride?
The InChIKey is JRCIBRAPPARQNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O3.ClH/c1-4-5-10(14)13(16)15-11-8-9(17-2)6-7-12(11)18-3;/h6-8,10H,4-5,14H2,1-3H3,(H,15,16);1H.
What are the key properties of 2-amino-N-(2,5-dimethoxyphenyl)pentanamide;hydrochloride?
2-amino-N-(2,5-dimethoxyphenyl)pentanamide;hydrochloride has a molecular weight of 288.78 g/mol, XLogP of 2.19, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2,5-dimethoxyphenyl)pentanamide;hydrochloride is sourced from PubChem (CID 119263329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).