N-[(1R)-1-(2-bromophenyl)ethyl]-2-(3,4-dimethylphenyl)acetamide

C18H20BrNO — CID 8759712

IUPACN-[(1R)-1-(2-bromophenyl)ethyl]-2-(3,4-dimethylphenyl)acetamide
SMILESCc1ccc(CC(=O)N[C@H](C)c2ccccc2Br)cc1C
InChIInChI=1S/C18H20BrNO/c1-12-8-9-15(10-13(12)2)11-18(21)20-14(3)16-6-4-5-7-17(16)19/h4-10,14H,11H2,1-3H3,(H,20,21)/t14-/m1/s1
InChIKeyAXKRQHPVFNXKCX-CQSZACIVSA-N
MW346.27 g/mol
LogP4.49
Rot. Bonds4

About N-[(1R)-1-(2-bromophenyl)ethyl]-2-(3,4-dimethylphenyl)acetamide

N-[(1R)-1-(2-bromophenyl)ethyl]-2-(3,4-dimethylphenyl)acetamide (PubChem CID 8759712) has the molecular formula C18H20BrNO and a molecular weight of 346.27 g/mol. Its IUPAC name is N-[(1R)-1-(2-bromophenyl)ethyl]-2-(3,4-dimethylphenyl)acetamide.

Molecular Properties

Compound NameN-[(1R)-1-(2-bromophenyl)ethyl]-2-(3,4-dimethylphenyl)acetamide
PubChem CID8759712
Molecular FormulaC18H20BrNO
Molecular Weight346.27 g/mol
Exact Mass345.07
IUPAC NameN-[(1R)-1-(2-bromophenyl)ethyl]-2-(3,4-dimethylphenyl)acetamide
SMILESCc1ccc(CC(=O)N[C@H](C)c2ccccc2Br)cc1C
InChIInChI=1S/C18H20BrNO/c1-12-8-9-15(10-13(12)2)11-18(21)20-14(3)16-6-4-5-7-17(16)19/h4-10,14H,11H2,1-3H3,(H,20,21)/t14-/m1/s1
InChIKeyAXKRQHPVFNXKCX-CQSZACIVSA-N
XLogP4.49
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.27
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[1-(2-bromophenyl)ethyl]-2-(4-hydroxyphenyl)acetamide
CID 78807026
2-(4-aminophenyl)-N-[(1R)-1-(2-bromophenyl)ethyl]acetamide
CID 81383148
2-(4-methoxy-3-methylphenyl)-N-[1-(2-methylphenyl)ethyl]acetamide
CID 133187396
N-[1-(2-bromophenyl)ethyl]-2-(2-chlorophenyl)acetamide
CID 42998474
3-(3,4-dimethylphenyl)-N-[1-(2-methoxyphenyl)ethyl]propanamide
CID 133160279
3-amino-N-[1-(2-bromophenyl)ethyl]butanamide
CID 60837651
N-[1-(2-bromophenyl)ethyl]-4-hydroxypentanamide
CID 79205047
N-[1-(2-bromophenyl)ethyl]-3-(3,4-dimethoxyphenyl)propanamide
CID 42999118
N-[(1S)-1-(2-bromophenyl)ethyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 9152244
2-(3,4-dimethylphenyl)-N-[(1R)-1-pyridin-4-ylethyl]acetamide
CID 51410979
N-[1-(2-methylphenyl)ethyl]-2-phenylacetamide
CID 59082083
N-[(1R)-1-(2-bromophenyl)ethyl]-2-(3-methylphenoxy)acetamide
CID 8759816

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-(2-bromophenyl)ethyl]-2-(3,4-dimethylphenyl)acetamide?
The IUPAC name of N-[(1R)-1-(2-bromophenyl)ethyl]-2-(3,4-dimethylphenyl)acetamide (CID 8759712) is N-[(1R)-1-(2-bromophenyl)ethyl]-2-(3,4-dimethylphenyl)acetamide.
What is the SMILES notation for N-[(1R)-1-(2-bromophenyl)ethyl]-2-(3,4-dimethylphenyl)acetamide?
The canonical SMILES for N-[(1R)-1-(2-bromophenyl)ethyl]-2-(3,4-dimethylphenyl)acetamide is Cc1ccc(CC(=O)N[C@H](C)c2ccccc2Br)cc1C.
What is the InChIKey of N-[(1R)-1-(2-bromophenyl)ethyl]-2-(3,4-dimethylphenyl)acetamide?
The InChIKey is AXKRQHPVFNXKCX-CQSZACIVSA-N. The full InChI is InChI=1S/C18H20BrNO/c1-12-8-9-15(10-13(12)2)11-18(21)20-14(3)16-6-4-5-7-17(16)19/h4-10,14H,11H2,1-3H3,(H,20,21)/t14-/m1/s1.
What are the key properties of N-[(1R)-1-(2-bromophenyl)ethyl]-2-(3,4-dimethylphenyl)acetamide?
N-[(1R)-1-(2-bromophenyl)ethyl]-2-(3,4-dimethylphenyl)acetamide has a molecular weight of 346.27 g/mol, XLogP of 4.49, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-(2-bromophenyl)ethyl]-2-(3,4-dimethylphenyl)acetamide is sourced from PubChem (CID 8759712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).