2-amino-N-[(2-chlorophenyl)-(2-methoxyphenyl)methyl]pentanamide

C19H23ClN2O2 — CID 119333887

IUPAC2-amino-N-[(2-chlorophenyl)-(2-methoxyphenyl)methyl]pentanamide
SMILESCCCC(N)C(=O)NC(c1ccccc1Cl)c1ccccc1OC
InChIInChI=1S/C19H23ClN2O2/c1-3-8-16(21)19(23)22-18(13-9-4-6-11-15(13)20)14-10-5-7-12-17(14)24-2/h4-7,9-12,16,18H,3,8,21H2,1-2H3,(H,22,23)
InChIKeyHNMDGPCOTDJPSU-UHFFFAOYSA-N
MW346.86 g/mol
LogP3.68
Rot. Bonds7

About 2-amino-N-[(2-chlorophenyl)-(2-methoxyphenyl)methyl]pentanamide

2-amino-N-[(2-chlorophenyl)-(2-methoxyphenyl)methyl]pentanamide (PubChem CID 119333887) has the molecular formula C19H23ClN2O2 and a molecular weight of 346.86 g/mol. Its IUPAC name is 2-amino-N-[(2-chlorophenyl)-(2-methoxyphenyl)methyl]pentanamide.

Molecular Properties

Compound Name2-amino-N-[(2-chlorophenyl)-(2-methoxyphenyl)methyl]pentanamide
PubChem CID119333887
Molecular FormulaC19H23ClN2O2
Molecular Weight346.86 g/mol
Exact Mass346.14
IUPAC Name2-amino-N-[(2-chlorophenyl)-(2-methoxyphenyl)methyl]pentanamide
SMILESCCCC(N)C(=O)NC(c1ccccc1Cl)c1ccccc1OC
InChIInChI=1S/C19H23ClN2O2/c1-3-8-16(21)19(23)22-18(13-9-4-6-11-15(13)20)14-10-5-7-12-17(14)24-2/h4-7,9-12,16,18H,3,8,21H2,1-2H3,(H,22,23)
InChIKeyHNMDGPCOTDJPSU-UHFFFAOYSA-N
XLogP3.68
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.86
LogP ≤ 53.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[(2-chlorophenyl)-(2,4-dimethoxyphenyl)methyl]-3-methoxypropanamide;hydrochloride
CID 120991275
2-amino-N-[(2-chloro-6-methoxyphenyl)methyl]pentanamide
CID 103292496
2-amino-N-[2-hydroxy-2-(2-methoxyphenyl)ethyl]pentanamide
CID 119293185
2-amino-N-[(4-chlorophenyl)-phenylmethyl]pentanamide
CID 119271036
2-amino-N-[(3-bromo-4-methoxyphenyl)-phenylmethyl]pentanamide;hydrochloride
CID 119318972
2-amino-N-[2-(2-methoxyphenyl)ethyl]pentanamide
CID 113228128
2-amino-N-[1-(2-methoxy-5-methylphenyl)ethyl]pentanamide
CID 43703461
2-amino-N-[1-(2-chlorophenyl)ethyl]-N-methylpentanamide
CID 54870533
4-amino-5-[[(1S)-1-(2-methoxyphenyl)ethyl]amino]-5-oxopentanoic acid
CID 81387858
2-amino-N-[phenyl(pyridin-3-yl)methyl]pentanamide
CID 119875674
2-amino-N-[[2-[(2-chlorophenoxy)methyl]phenyl]methyl]pentanamide
CID 119333070
methyl 2-(2-aminopentanoylamino)-2-phenylacetate
CID 62111189

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[(2-chlorophenyl)-(2-methoxyphenyl)methyl]pentanamide?
The IUPAC name of 2-amino-N-[(2-chlorophenyl)-(2-methoxyphenyl)methyl]pentanamide (CID 119333887) is 2-amino-N-[(2-chlorophenyl)-(2-methoxyphenyl)methyl]pentanamide.
What is the SMILES notation for 2-amino-N-[(2-chlorophenyl)-(2-methoxyphenyl)methyl]pentanamide?
The canonical SMILES for 2-amino-N-[(2-chlorophenyl)-(2-methoxyphenyl)methyl]pentanamide is CCCC(N)C(=O)NC(c1ccccc1Cl)c1ccccc1OC.
What is the InChIKey of 2-amino-N-[(2-chlorophenyl)-(2-methoxyphenyl)methyl]pentanamide?
The InChIKey is HNMDGPCOTDJPSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23ClN2O2/c1-3-8-16(21)19(23)22-18(13-9-4-6-11-15(13)20)14-10-5-7-12-17(14)24-2/h4-7,9-12,16,18H,3,8,21H2,1-2H3,(H,22,23).
What are the key properties of 2-amino-N-[(2-chlorophenyl)-(2-methoxyphenyl)methyl]pentanamide?
2-amino-N-[(2-chlorophenyl)-(2-methoxyphenyl)methyl]pentanamide has a molecular weight of 346.86 g/mol, XLogP of 3.68, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[(2-chlorophenyl)-(2-methoxyphenyl)methyl]pentanamide is sourced from PubChem (CID 119333887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).