2-benzamido-2-(2-methylphenyl)acetic acid

C16H15NO3 — CID 82092810

IUPAC2-benzamido-2-(2-methylphenyl)acetic acid
SMILESCc1ccccc1C(NC(=O)c1ccccc1)C(=O)O
InChIInChI=1S/C16H15NO3/c1-11-7-5-6-10-13(11)14(16(19)20)17-15(18)12-8-3-2-4-9-12/h2-10,14H,1H3,(H,17,18)(H,19,20)
InChIKeyREWVKWVXJBTUJL-UHFFFAOYSA-N
MW269.30 g/mol
LogP2.55
Rot. Bonds4

About 2-benzamido-2-(2-methylphenyl)acetic acid

2-benzamido-2-(2-methylphenyl)acetic acid (PubChem CID 82092810) has the molecular formula C16H15NO3 and a molecular weight of 269.30 g/mol. Its IUPAC name is 2-benzamido-2-(2-methylphenyl)acetic acid.

Molecular Properties

Compound Name2-benzamido-2-(2-methylphenyl)acetic acid
PubChem CID82092810
Molecular FormulaC16H15NO3
Molecular Weight269.30 g/mol
Exact Mass269.11
IUPAC Name2-benzamido-2-(2-methylphenyl)acetic acid
SMILESCc1ccccc1C(NC(=O)c1ccccc1)C(=O)O
InChIInChI=1S/C16H15NO3/c1-11-7-5-6-10-13(11)14(16(19)20)17-15(18)12-8-3-2-4-9-12/h2-10,14H,1H3,(H,17,18)(H,19,20)
InChIKeyREWVKWVXJBTUJL-UHFFFAOYSA-N
XLogP2.55
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-(methoxycarbonylamino)-2-(2-methylphenyl)acetic acid
CID 67681824
2-(3-methoxypropanoylamino)-2-(2-methylphenyl)acetic acid
CID 112508882
2-(cyclopentanecarbonylamino)-2-(2-methylphenyl)acetic acid
CID 82090476
(2R)-2-[(4-aminobenzoyl)amino]-2-(2-chlorophenyl)acetic acid
CID 107315149
N-[2-[1-(2-methylphenyl)ethylamino]-2-oxoethyl]benzamide
CID 42910539
2-benzamido-2-[2-(4,4,4-trifluorobutyl)phenyl]acetic acid
CID 155933877
(2R)-2-(2-chlorophenyl)-2-[(5-methylfuran-3-carbonyl)amino]acetic acid
CID 107314767
2,2-dibenzamidoacetic acid
CID 12521150
2-acetamido-2-(2,3-dimethylphenyl)acetic acid
CID 63701891
2-[(3-fluorobenzoyl)amino]-2-(2-fluorophenyl)acetic acid
CID 75357523
4-iodo-N-[(2-methylphenyl)-phenylmethyl]benzamide
CID 132610512
4-N-[1-(2-methylphenyl)ethyl]benzene-1,4-dicarboxamide
CID 51175514

Frequently Asked Questions

What is the IUPAC name of 2-benzamido-2-(2-methylphenyl)acetic acid?
The IUPAC name of 2-benzamido-2-(2-methylphenyl)acetic acid (CID 82092810) is 2-benzamido-2-(2-methylphenyl)acetic acid.
What is the SMILES notation for 2-benzamido-2-(2-methylphenyl)acetic acid?
The canonical SMILES for 2-benzamido-2-(2-methylphenyl)acetic acid is Cc1ccccc1C(NC(=O)c1ccccc1)C(=O)O.
What is the InChIKey of 2-benzamido-2-(2-methylphenyl)acetic acid?
The InChIKey is REWVKWVXJBTUJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO3/c1-11-7-5-6-10-13(11)14(16(19)20)17-15(18)12-8-3-2-4-9-12/h2-10,14H,1H3,(H,17,18)(H,19,20).
What are the key properties of 2-benzamido-2-(2-methylphenyl)acetic acid?
2-benzamido-2-(2-methylphenyl)acetic acid has a molecular weight of 269.30 g/mol, XLogP of 2.55, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzamido-2-(2-methylphenyl)acetic acid is sourced from PubChem (CID 82092810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).