N-[(2R)-1-(4-chlorophenyl)propan-2-yl]-2-methoxyacetamide

C12H16ClNO2 — CID 51948159

IUPACN-[(2R)-1-(4-chlorophenyl)propan-2-yl]-2-methoxyacetamide
SMILESCOCC(=O)N[C@H](C)Cc1ccc(Cl)cc1
InChIInChI=1S/C12H16ClNO2/c1-9(14-12(15)8-16-2)7-10-3-5-11(13)6-4-10/h3-6,9H,7-8H2,1-2H3,(H,14,15)/t9-/m1/s1
InChIKeyAVTLPRITMAYAHC-SECBINFHSA-N
MW241.72 g/mol
LogP2.03
Rot. Bonds5

About N-[(2R)-1-(4-chlorophenyl)propan-2-yl]-2-methoxyacetamide

N-[(2R)-1-(4-chlorophenyl)propan-2-yl]-2-methoxyacetamide (PubChem CID 51948159) has the molecular formula C12H16ClNO2 and a molecular weight of 241.72 g/mol. Its IUPAC name is N-[(2R)-1-(4-chlorophenyl)propan-2-yl]-2-methoxyacetamide.

Molecular Properties

Compound NameN-[(2R)-1-(4-chlorophenyl)propan-2-yl]-2-methoxyacetamide
PubChem CID51948159
Molecular FormulaC12H16ClNO2
Molecular Weight241.72 g/mol
Exact Mass241.09
IUPAC NameN-[(2R)-1-(4-chlorophenyl)propan-2-yl]-2-methoxyacetamide
SMILESCOCC(=O)N[C@H](C)Cc1ccc(Cl)cc1
InChIInChI=1S/C12H16ClNO2/c1-9(14-12(15)8-16-2)7-10-3-5-11(13)6-4-10/h3-6,9H,7-8H2,1-2H3,(H,14,15)/t9-/m1/s1
InChIKeyAVTLPRITMAYAHC-SECBINFHSA-N
XLogP2.03
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.72
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-chlorophenoxy)-N-[1-(4-methylphenyl)propan-2-yl]acetamide
CID 123862391
N-[1-(4-chlorophenyl)ethyl]-2-methoxyacetamide
CID 18374039
N-[1-(4-chlorophenyl)propan-2-yl]-4-hydroxybutanamide
CID 79200504
N-[1-(4-chlorophenyl)propan-2-yl]-2-methylpropanamide
CID 60769951
N-[1-(3,5-dimethylphenyl)propan-2-yl]-2-methoxyacetamide
CID 71998958
N-[1-(4-chlorophenyl)propan-2-yl]-5-hydroxypentanamide
CID 79199126
6-amino-N-[1-(4-chlorophenyl)propan-2-yl]hexanamide
CID 43700876
2-anilino-N-[1-(4-chlorophenyl)propan-2-yl]acetamide
CID 60860440
2-[(4-chlorophenyl)methylamino]-N-(1-methoxypropan-2-yl)acetamide
CID 60684118
methyl (2S)-3-(4-chlorophenyl)-2-methylpropanoate
CID 40999700
2-methoxy-N-[1-(2-methylphenyl)propan-2-yl]acetamide
CID 47062728
3-[1-(4-chlorophenyl)propan-2-ylamino]-N-(2-methoxyethyl)propanamide
CID 103910437

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-(4-chlorophenyl)propan-2-yl]-2-methoxyacetamide?
The IUPAC name of N-[(2R)-1-(4-chlorophenyl)propan-2-yl]-2-methoxyacetamide (CID 51948159) is N-[(2R)-1-(4-chlorophenyl)propan-2-yl]-2-methoxyacetamide.
What is the SMILES notation for N-[(2R)-1-(4-chlorophenyl)propan-2-yl]-2-methoxyacetamide?
The canonical SMILES for N-[(2R)-1-(4-chlorophenyl)propan-2-yl]-2-methoxyacetamide is COCC(=O)N[C@H](C)Cc1ccc(Cl)cc1.
What is the InChIKey of N-[(2R)-1-(4-chlorophenyl)propan-2-yl]-2-methoxyacetamide?
The InChIKey is AVTLPRITMAYAHC-SECBINFHSA-N. The full InChI is InChI=1S/C12H16ClNO2/c1-9(14-12(15)8-16-2)7-10-3-5-11(13)6-4-10/h3-6,9H,7-8H2,1-2H3,(H,14,15)/t9-/m1/s1.
What are the key properties of N-[(2R)-1-(4-chlorophenyl)propan-2-yl]-2-methoxyacetamide?
N-[(2R)-1-(4-chlorophenyl)propan-2-yl]-2-methoxyacetamide has a molecular weight of 241.72 g/mol, XLogP of 2.03, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-(4-chlorophenyl)propan-2-yl]-2-methoxyacetamide is sourced from PubChem (CID 51948159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).