(2S)-2-amino-N-[2-(4-methoxyphenyl)ethyl]-3-methylpentanamide

C15H24N2O2 — CID 22690831

IUPAC(2S)-2-amino-N-[2-(4-methoxyphenyl)ethyl]-3-methylpentanamide
SMILESCCC(C)[C@H](N)C(=O)NCCc1ccc(OC)cc1
InChIInChI=1S/C15H24N2O2/c1-4-11(2)14(16)15(18)17-10-9-12-5-7-13(19-3)8-6-12/h5-8,11,14H,4,9-10,16H2,1-3H3,(H,17,18)/t11?,14-/m0/s1
InChIKeyUJVBONHFFFJFCU-IAXJKZSUSA-N
MW264.37 g/mol
LogP1.73
Rot. Bonds7

About (2S)-2-amino-N-[2-(4-methoxyphenyl)ethyl]-3-methylpentanamide

(2S)-2-amino-N-[2-(4-methoxyphenyl)ethyl]-3-methylpentanamide (PubChem CID 22690831) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is (2S)-2-amino-N-[2-(4-methoxyphenyl)ethyl]-3-methylpentanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-[2-(4-methoxyphenyl)ethyl]-3-methylpentanamide
PubChem CID22690831
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name(2S)-2-amino-N-[2-(4-methoxyphenyl)ethyl]-3-methylpentanamide
SMILESCCC(C)[C@H](N)C(=O)NCCc1ccc(OC)cc1
InChIInChI=1S/C15H24N2O2/c1-4-11(2)14(16)15(18)17-10-9-12-5-7-13(19-3)8-6-12/h5-8,11,14H,4,9-10,16H2,1-3H3,(H,17,18)/t11?,14-/m0/s1
InChIKeyUJVBONHFFFJFCU-IAXJKZSUSA-N
XLogP1.73
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (2S)-2-amino-N-[2-(4-methoxyphenyl)ethyl]-3-methylpentanamide 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

2-amino-N-[2-(4-methoxyphenyl)ethyl]butanamide
CID 43649353
2-amino-N-[2-(4-methoxyphenyl)ethyl]propanamide
CID 24710031
(2S,3S)-2-amino-N-[2-[4-(difluoromethoxy)phenyl]ethyl]-3-methylpentanamide
CID 61259364
(2S)-2-amino-3-methyl-N-(2-phenylethyl)pentanamide;hydrochloride
CID 67640844
2-amino-N-[3-(4-methoxyphenyl)butyl]-3-methylpentanamide
CID 119799848
(2R)-2-hydroxy-N-[2-(4-methoxyphenyl)ethyl]propanamide
CID 175743514
2-amino-N-[(6-methoxynaphthalen-2-yl)methyl]-3-methylpentanamide;hydrochloride
CID 119699304
3-amino-4-[2-(4-methoxyphenyl)ethylamino]-4-oxobutanoic acid
CID 18330162
3-amino-N-[2-(4-methoxyphenyl)ethyl]-2-methyl-3-phenylpropanamide
CID 119673161
2-amino-N-[2-(4-methoxyphenyl)-2-methylpropyl]-3-methylpentanamide
CID 119758287
2-amino-N-[2-[3-(difluoromethoxy)-4-methoxyphenyl]ethyl]-3-methylpentanamide
CID 119767861
(2S)-2-amino-N'-(4-methoxyphenyl)-3-methylpentanehydrazide
CID 68721410

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-[2-(4-methoxyphenyl)ethyl]-3-methylpentanamide?
The IUPAC name of (2S)-2-amino-N-[2-(4-methoxyphenyl)ethyl]-3-methylpentanamide (CID 22690831) is (2S)-2-amino-N-[2-(4-methoxyphenyl)ethyl]-3-methylpentanamide.
What is the SMILES notation for (2S)-2-amino-N-[2-(4-methoxyphenyl)ethyl]-3-methylpentanamide?
The canonical SMILES for (2S)-2-amino-N-[2-(4-methoxyphenyl)ethyl]-3-methylpentanamide is CCC(C)[C@H](N)C(=O)NCCc1ccc(OC)cc1.
What is the InChIKey of (2S)-2-amino-N-[2-(4-methoxyphenyl)ethyl]-3-methylpentanamide?
The InChIKey is UJVBONHFFFJFCU-IAXJKZSUSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-4-11(2)14(16)15(18)17-10-9-12-5-7-13(19-3)8-6-12/h5-8,11,14H,4,9-10,16H2,1-3H3,(H,17,18)/t11?,14-/m0/s1.
What are the key properties of (2S)-2-amino-N-[2-(4-methoxyphenyl)ethyl]-3-methylpentanamide?
(2S)-2-amino-N-[2-(4-methoxyphenyl)ethyl]-3-methylpentanamide has a molecular weight of 264.37 g/mol, XLogP of 1.73, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-[2-(4-methoxyphenyl)ethyl]-3-methylpentanamide is sourced from PubChem (CID 22690831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).