(2R)-2-(2-chlorophenyl)-2-[(3-hydroxypyridine-4-carbonyl)amino]acetic acid

C14H11ClN2O4 — CID 107314458

IUPAC(2R)-2-(2-chlorophenyl)-2-[(3-hydroxypyridine-4-carbonyl)amino]acetic acid
SMILESO=C(N[C@@H](C(=O)O)c1ccccc1Cl)c1ccncc1O
InChIInChI=1S/C14H11ClN2O4/c15-10-4-2-1-3-8(10)12(14(20)21)17-13(19)9-5-6-16-7-11(9)18/h1-7,12,18H,(H,17,19)(H,20,21)/t12-/m1/s1
InChIKeyQGXPVMKDNSCECH-GFCCVEGCSA-N
MW306.71 g/mol
LogP2.00
Rot. Bonds4

About (2R)-2-(2-chlorophenyl)-2-[(3-hydroxypyridine-4-carbonyl)amino]acetic acid

(2R)-2-(2-chlorophenyl)-2-[(3-hydroxypyridine-4-carbonyl)amino]acetic acid (PubChem CID 107314458) has the molecular formula C14H11ClN2O4 and a molecular weight of 306.71 g/mol. Its IUPAC name is (2R)-2-(2-chlorophenyl)-2-[(3-hydroxypyridine-4-carbonyl)amino]acetic acid.

Molecular Properties

Compound Name(2R)-2-(2-chlorophenyl)-2-[(3-hydroxypyridine-4-carbonyl)amino]acetic acid
PubChem CID107314458
Molecular FormulaC14H11ClN2O4
Molecular Weight306.71 g/mol
Exact Mass306.04
IUPAC Name(2R)-2-(2-chlorophenyl)-2-[(3-hydroxypyridine-4-carbonyl)amino]acetic acid
SMILESO=C(N[C@@H](C(=O)O)c1ccccc1Cl)c1ccncc1O
InChIInChI=1S/C14H11ClN2O4/c15-10-4-2-1-3-8(10)12(14(20)21)17-13(19)9-5-6-16-7-11(9)18/h1-7,12,18H,(H,17,19)(H,20,21)/t12-/m1/s1
InChIKeyQGXPVMKDNSCECH-GFCCVEGCSA-N
XLogP2.00
TPSA99.52 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.71
LogP ≤ 52.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-2-(2-chlorophenyl)-2-[(5-methyl-1H-pyrazole-4-carbonyl)amino]acetic acid
CID 107314362
N-(2-chlorophenyl)-3-hydroxypyridine-4-carboxamide
CID 81443413
(2R)-2-(2-chlorophenyl)-2-[(2,5-dimethylfuran-3-carbonyl)amino]acetic acid
CID 107314250
(2R)-2-(2-chlorophenyl)-2-[(5-fluoropyridine-2-carbonyl)amino]acetic acid
CID 107314623
(2R)-2-[(3-aminopyridine-2-carbonyl)amino]-2-(2-chlorophenyl)acetic acid
CID 107315066
(2R)-2-[(4-aminobenzoyl)amino]-2-(2-chlorophenyl)acetic acid
CID 107315149
(2R)-2-[(3-hydroxypyridine-4-carbonyl)amino]butanoic acid
CID 81445874
(2R)-2-(2-chlorophenyl)-2-[(3,5-dimethyl-1,2-oxazole-4-carbonyl)amino]acetic acid
CID 107314790
(2S)-2-[(3-chloropyridine-4-carbonyl)amino]propanoic acid
CID 66462207
N-(2,3-dichlorophenyl)-3-hydroxypyridine-4-carboxamide
CID 81443246
3-hydroxy-N-(1-hydroxy-3-phenylpropan-2-yl)pyridine-4-carboxamide
CID 81442857
(2R)-2-(2-chlorophenyl)-2-[(6-oxo-1H-pyridazine-3-carbonyl)amino]acetic acid
CID 107314268

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2-chlorophenyl)-2-[(3-hydroxypyridine-4-carbonyl)amino]acetic acid?
The IUPAC name of (2R)-2-(2-chlorophenyl)-2-[(3-hydroxypyridine-4-carbonyl)amino]acetic acid (CID 107314458) is (2R)-2-(2-chlorophenyl)-2-[(3-hydroxypyridine-4-carbonyl)amino]acetic acid.
What is the SMILES notation for (2R)-2-(2-chlorophenyl)-2-[(3-hydroxypyridine-4-carbonyl)amino]acetic acid?
The canonical SMILES for (2R)-2-(2-chlorophenyl)-2-[(3-hydroxypyridine-4-carbonyl)amino]acetic acid is O=C(N[C@@H](C(=O)O)c1ccccc1Cl)c1ccncc1O.
What is the InChIKey of (2R)-2-(2-chlorophenyl)-2-[(3-hydroxypyridine-4-carbonyl)amino]acetic acid?
The InChIKey is QGXPVMKDNSCECH-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H11ClN2O4/c15-10-4-2-1-3-8(10)12(14(20)21)17-13(19)9-5-6-16-7-11(9)18/h1-7,12,18H,(H,17,19)(H,20,21)/t12-/m1/s1.
What are the key properties of (2R)-2-(2-chlorophenyl)-2-[(3-hydroxypyridine-4-carbonyl)amino]acetic acid?
(2R)-2-(2-chlorophenyl)-2-[(3-hydroxypyridine-4-carbonyl)amino]acetic acid has a molecular weight of 306.71 g/mol, XLogP of 2.00, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2-chlorophenyl)-2-[(3-hydroxypyridine-4-carbonyl)amino]acetic acid is sourced from PubChem (CID 107314458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).