2-(2-hydroxyphenyl)-N-[(2S)-1-(3-methoxyphenyl)propan-2-yl]acetamide

C18H21NO3 — CID 96532447

IUPAC2-(2-hydroxyphenyl)-N-[(2S)-1-(3-methoxyphenyl)propan-2-yl]acetamide
SMILESCOc1cccc(C[C@H](C)NC(=O)Cc2ccccc2O)c1
InChIInChI=1S/C18H21NO3/c1-13(10-14-6-5-8-16(11-14)22-2)19-18(21)12-15-7-3-4-9-17(15)20/h3-9,11,13,20H,10,12H2,1-2H3,(H,19,21)/t13-/m0/s1
InChIKeyNHWUFEVRMMVCIT-ZDUSSCGKSA-N
MW299.37 g/mol
LogP2.69
Rot. Bonds6

About 2-(2-hydroxyphenyl)-N-[(2S)-1-(3-methoxyphenyl)propan-2-yl]acetamide

2-(2-hydroxyphenyl)-N-[(2S)-1-(3-methoxyphenyl)propan-2-yl]acetamide (PubChem CID 96532447) has the molecular formula C18H21NO3 and a molecular weight of 299.37 g/mol. Its IUPAC name is 2-(2-hydroxyphenyl)-N-[(2S)-1-(3-methoxyphenyl)propan-2-yl]acetamide.

Molecular Properties

Compound Name2-(2-hydroxyphenyl)-N-[(2S)-1-(3-methoxyphenyl)propan-2-yl]acetamide
PubChem CID96532447
Molecular FormulaC18H21NO3
Molecular Weight299.37 g/mol
Exact Mass299.15
IUPAC Name2-(2-hydroxyphenyl)-N-[(2S)-1-(3-methoxyphenyl)propan-2-yl]acetamide
SMILESCOc1cccc(C[C@H](C)NC(=O)Cc2ccccc2O)c1
InChIInChI=1S/C18H21NO3/c1-13(10-14-6-5-8-16(11-14)22-2)19-18(21)12-15-7-3-4-9-17(15)20/h3-9,11,13,20H,10,12H2,1-2H3,(H,19,21)/t13-/m0/s1
InChIKeyNHWUFEVRMMVCIT-ZDUSSCGKSA-N
XLogP2.69
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2R)-1-(3-methoxyphenyl)propan-2-yl]butanamide
CID 174918939
N-[1-(3-methoxyphenyl)propan-2-yl]butanamide
CID 174918913
N-[1-(3-methoxyphenyl)propan-2-yl]acetamide
CID 541954
N-[(2-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide
CID 115598846
2-(2-methoxyanilino)-N-[(2S)-1-(3-methoxyphenyl)propan-2-yl]acetamide
CID 96534561
N-(4-hydroxybutan-2-yl)-2-(3-methoxyphenyl)acetamide
CID 81049875
N-(1-bromopropan-2-yl)-2-(3-methoxyphenyl)acetamide
CID 114310600
1-benzyl-3-[1-(3-methoxyphenyl)propan-2-yl]-1-propan-2-ylurea
CID 86943865
2-(3-methoxyphenyl)-N-[(2R)-1-thiophen-2-ylpropan-2-yl]acetamide
CID 51895007
4-[3-[1-(3-methoxyphenyl)propan-2-ylamino]-3-oxopropyl]benzoic acid
CID 119185222
2-(3-methoxyphenyl)-N-[(2S)-4-oxo-4-phenylbutan-2-yl]acetamide
CID 97086495
2-(3-methoxyphenyl)-N-(3-methylbutan-2-yl)acetamide
CID 78799670

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyphenyl)-N-[(2S)-1-(3-methoxyphenyl)propan-2-yl]acetamide?
The IUPAC name of 2-(2-hydroxyphenyl)-N-[(2S)-1-(3-methoxyphenyl)propan-2-yl]acetamide (CID 96532447) is 2-(2-hydroxyphenyl)-N-[(2S)-1-(3-methoxyphenyl)propan-2-yl]acetamide.
What is the SMILES notation for 2-(2-hydroxyphenyl)-N-[(2S)-1-(3-methoxyphenyl)propan-2-yl]acetamide?
The canonical SMILES for 2-(2-hydroxyphenyl)-N-[(2S)-1-(3-methoxyphenyl)propan-2-yl]acetamide is COc1cccc(C[C@H](C)NC(=O)Cc2ccccc2O)c1.
What is the InChIKey of 2-(2-hydroxyphenyl)-N-[(2S)-1-(3-methoxyphenyl)propan-2-yl]acetamide?
The InChIKey is NHWUFEVRMMVCIT-ZDUSSCGKSA-N. The full InChI is InChI=1S/C18H21NO3/c1-13(10-14-6-5-8-16(11-14)22-2)19-18(21)12-15-7-3-4-9-17(15)20/h3-9,11,13,20H,10,12H2,1-2H3,(H,19,21)/t13-/m0/s1.
What are the key properties of 2-(2-hydroxyphenyl)-N-[(2S)-1-(3-methoxyphenyl)propan-2-yl]acetamide?
2-(2-hydroxyphenyl)-N-[(2S)-1-(3-methoxyphenyl)propan-2-yl]acetamide has a molecular weight of 299.37 g/mol, XLogP of 2.69, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyphenyl)-N-[(2S)-1-(3-methoxyphenyl)propan-2-yl]acetamide is sourced from PubChem (CID 96532447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).