2-[(2-amino-6-phenylpyridine-3-carbonyl)amino]acetic acid

C14H13N3O3 — CID 174643907

IUPAC2-[(2-amino-6-phenylpyridine-3-carbonyl)amino]acetic acid
SMILESNc1nc(-c2ccccc2)ccc1C(=O)NCC(=O)O
InChIInChI=1S/C14H13N3O3/c15-13-10(14(20)16-8-12(18)19)6-7-11(17-13)9-4-2-1-3-5-9/h1-7H,8H2,(H2,15,17)(H,16,20)(H,18,19)
InChIKeyYGVWIMBFMSWDPH-UHFFFAOYSA-N
MW271.28 g/mol
LogP1.15
Rot. Bonds4

About 2-[(2-amino-6-phenylpyridine-3-carbonyl)amino]acetic acid

2-[(2-amino-6-phenylpyridine-3-carbonyl)amino]acetic acid (PubChem CID 174643907) has the molecular formula C14H13N3O3 and a molecular weight of 271.28 g/mol. Its IUPAC name is 2-[(2-amino-6-phenylpyridine-3-carbonyl)amino]acetic acid.

Molecular Properties

Compound Name2-[(2-amino-6-phenylpyridine-3-carbonyl)amino]acetic acid
PubChem CID174643907
Molecular FormulaC14H13N3O3
Molecular Weight271.28 g/mol
Exact Mass271.10
IUPAC Name2-[(2-amino-6-phenylpyridine-3-carbonyl)amino]acetic acid
SMILESNc1nc(-c2ccccc2)ccc1C(=O)NCC(=O)O
InChIInChI=1S/C14H13N3O3/c15-13-10(14(20)16-8-12(18)19)6-7-11(17-13)9-4-2-1-3-5-9/h1-7H,8H2,(H2,15,17)(H,16,20)(H,18,19)
InChIKeyYGVWIMBFMSWDPH-UHFFFAOYSA-N
XLogP1.15
TPSA105.31 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.28
LogP ≤ 51.15
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-amino-6-phenylpyridine-3-carbonyl)amino]acetic acid?
The IUPAC name of 2-[(2-amino-6-phenylpyridine-3-carbonyl)amino]acetic acid (CID 174643907) is 2-[(2-amino-6-phenylpyridine-3-carbonyl)amino]acetic acid.
What is the SMILES notation for 2-[(2-amino-6-phenylpyridine-3-carbonyl)amino]acetic acid?
The canonical SMILES for 2-[(2-amino-6-phenylpyridine-3-carbonyl)amino]acetic acid is Nc1nc(-c2ccccc2)ccc1C(=O)NCC(=O)O.
What is the InChIKey of 2-[(2-amino-6-phenylpyridine-3-carbonyl)amino]acetic acid?
The InChIKey is YGVWIMBFMSWDPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O3/c15-13-10(14(20)16-8-12(18)19)6-7-11(17-13)9-4-2-1-3-5-9/h1-7H,8H2,(H2,15,17)(H,16,20)(H,18,19).
What are the key properties of 2-[(2-amino-6-phenylpyridine-3-carbonyl)amino]acetic acid?
2-[(2-amino-6-phenylpyridine-3-carbonyl)amino]acetic acid has a molecular weight of 271.28 g/mol, XLogP of 1.15, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-amino-6-phenylpyridine-3-carbonyl)amino]acetic acid is sourced from PubChem (CID 174643907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).