2-(furo[3,2-c]pyridine-4-carbonylamino)-2-(3-methoxyphenyl)acetic acid

C17H14N2O5 — CID 167858285

IUPAC2-(furo[3,2-c]pyridine-4-carbonylamino)-2-(3-methoxyphenyl)acetic acid
SMILESCOc1cccc(C(NC(=O)c2nccc3occc23)C(=O)O)c1
InChIInChI=1S/C17H14N2O5/c1-23-11-4-2-3-10(9-11)14(17(21)22)19-16(20)15-12-6-8-24-13(12)5-7-18-15/h2-9,14H,1H3,(H,19,20)(H,21,22)
InChIKeyYHSVCUKVMHKXRH-UHFFFAOYSA-N
MW326.31 g/mol
LogP2.39
Rot. Bonds5

About 2-(furo[3,2-c]pyridine-4-carbonylamino)-2-(3-methoxyphenyl)acetic acid

2-(furo[3,2-c]pyridine-4-carbonylamino)-2-(3-methoxyphenyl)acetic acid (PubChem CID 167858285) has the molecular formula C17H14N2O5 and a molecular weight of 326.31 g/mol. Its IUPAC name is 2-(furo[3,2-c]pyridine-4-carbonylamino)-2-(3-methoxyphenyl)acetic acid.

Molecular Properties

Compound Name2-(furo[3,2-c]pyridine-4-carbonylamino)-2-(3-methoxyphenyl)acetic acid
PubChem CID167858285
Molecular FormulaC17H14N2O5
Molecular Weight326.31 g/mol
Exact Mass326.09
IUPAC Name2-(furo[3,2-c]pyridine-4-carbonylamino)-2-(3-methoxyphenyl)acetic acid
SMILESCOc1cccc(C(NC(=O)c2nccc3occc23)C(=O)O)c1
InChIInChI=1S/C17H14N2O5/c1-23-11-4-2-3-10(9-11)14(17(21)22)19-16(20)15-12-6-8-24-13(12)5-7-18-15/h2-9,14H,1H3,(H,19,20)(H,21,22)
InChIKeyYHSVCUKVMHKXRH-UHFFFAOYSA-N
XLogP2.39
TPSA101.66 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.31
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(methoxycarbonylamino)-2-(3-methoxyphenyl)acetic acid
CID 22707097
2-(butanoylamino)-2-(3-methoxyphenyl)acetic acid
CID 112508886
2-(2,3-dihydro-1H-indene-4-carbonylamino)-2-(3-methoxyphenyl)acetic acid
CID 136552069
2-(3-methoxyphenyl)-2-(methylamino)acetamide
CID 60797274
2-(cyclohexylamino)-2-(3-methoxyphenyl)acetic acid
CID 54892787
N-[(R)-(4-methoxyphenyl)-phenylmethyl]isoquinoline-1-carboxamide
CID 52786837
(2S)-2-(3-methoxyphenyl)-2-[(2-methyloxane-3-carbonyl)amino]acetic acid
CID 136583903
2,2-bis(3-methoxyphenyl)acetic acid
CID 67016131
(2S)-2-(3-methoxyphenyl)-2-[[1-(4-methoxyphenyl)cyclopropanecarbonyl]amino]acetic acid
CID 178099809
2-[2-(dimethylamino)ethylamino]-2-(3-methoxyphenyl)acetic acid
CID 54894700
4-(3-methoxyanilino)-N-(1-phenylethyl)pyridine-2-carboxamide
CID 109210708
3-[(3-methoxyphenyl)carbamoyl]pyrazine-2-carboxylic acid
CID 20866755

Frequently Asked Questions

What is the IUPAC name of 2-(furo[3,2-c]pyridine-4-carbonylamino)-2-(3-methoxyphenyl)acetic acid?
The IUPAC name of 2-(furo[3,2-c]pyridine-4-carbonylamino)-2-(3-methoxyphenyl)acetic acid (CID 167858285) is 2-(furo[3,2-c]pyridine-4-carbonylamino)-2-(3-methoxyphenyl)acetic acid.
What is the SMILES notation for 2-(furo[3,2-c]pyridine-4-carbonylamino)-2-(3-methoxyphenyl)acetic acid?
The canonical SMILES for 2-(furo[3,2-c]pyridine-4-carbonylamino)-2-(3-methoxyphenyl)acetic acid is COc1cccc(C(NC(=O)c2nccc3occc23)C(=O)O)c1.
What is the InChIKey of 2-(furo[3,2-c]pyridine-4-carbonylamino)-2-(3-methoxyphenyl)acetic acid?
The InChIKey is YHSVCUKVMHKXRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O5/c1-23-11-4-2-3-10(9-11)14(17(21)22)19-16(20)15-12-6-8-24-13(12)5-7-18-15/h2-9,14H,1H3,(H,19,20)(H,21,22).
What are the key properties of 2-(furo[3,2-c]pyridine-4-carbonylamino)-2-(3-methoxyphenyl)acetic acid?
2-(furo[3,2-c]pyridine-4-carbonylamino)-2-(3-methoxyphenyl)acetic acid has a molecular weight of 326.31 g/mol, XLogP of 2.39, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furo[3,2-c]pyridine-4-carbonylamino)-2-(3-methoxyphenyl)acetic acid is sourced from PubChem (CID 167858285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).