N-[(6-hydroxyimidazo[1,2-a]pyridin-2-yl)methyl]-4-oxochromene-2-carboxamide

C18H13N3O4 — CID 170391703

IUPACN-[(6-hydroxyimidazo[1,2-a]pyridin-2-yl)methyl]-4-oxochromene-2-carboxamide
SMILESO=C(NCc1cn2cc(O)ccc2n1)c1cc(=O)c2ccccc2o1
InChIInChI=1S/C18H13N3O4/c22-12-5-6-17-20-11(9-21(17)10-12)8-19-18(24)16-7-14(23)13-3-1-2-4-15(13)25-16/h1-7,9-10,22H,8H2,(H,19,24)
InChIKeyIRFQPQJRZMSEAH-UHFFFAOYSA-N
MW335.32 g/mol
LogP2.08
Rot. Bonds3

About N-[(6-hydroxyimidazo[1,2-a]pyridin-2-yl)methyl]-4-oxochromene-2-carboxamide

N-[(6-hydroxyimidazo[1,2-a]pyridin-2-yl)methyl]-4-oxochromene-2-carboxamide (PubChem CID 170391703) has the molecular formula C18H13N3O4 and a molecular weight of 335.32 g/mol. Its IUPAC name is N-[(6-hydroxyimidazo[1,2-a]pyridin-2-yl)methyl]-4-oxochromene-2-carboxamide.

Molecular Properties

Compound NameN-[(6-hydroxyimidazo[1,2-a]pyridin-2-yl)methyl]-4-oxochromene-2-carboxamide
PubChem CID170391703
Molecular FormulaC18H13N3O4
Molecular Weight335.32 g/mol
Exact Mass335.09
IUPAC NameN-[(6-hydroxyimidazo[1,2-a]pyridin-2-yl)methyl]-4-oxochromene-2-carboxamide
SMILESO=C(NCc1cn2cc(O)ccc2n1)c1cc(=O)c2ccccc2o1
InChIInChI=1S/C18H13N3O4/c22-12-5-6-17-20-11(9-21(17)10-12)8-19-18(24)16-7-14(23)13-3-1-2-4-15(13)25-16/h1-7,9-10,22H,8H2,(H,19,24)
InChIKeyIRFQPQJRZMSEAH-UHFFFAOYSA-N
XLogP2.08
TPSA96.84 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.32
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[(6-hydroxyimidazo[1,2-a]pyridin-2-yl)methyl]-4-oxochromene-2-carboxamide?
The IUPAC name of N-[(6-hydroxyimidazo[1,2-a]pyridin-2-yl)methyl]-4-oxochromene-2-carboxamide (CID 170391703) is N-[(6-hydroxyimidazo[1,2-a]pyridin-2-yl)methyl]-4-oxochromene-2-carboxamide.
What is the SMILES notation for N-[(6-hydroxyimidazo[1,2-a]pyridin-2-yl)methyl]-4-oxochromene-2-carboxamide?
The canonical SMILES for N-[(6-hydroxyimidazo[1,2-a]pyridin-2-yl)methyl]-4-oxochromene-2-carboxamide is O=C(NCc1cn2cc(O)ccc2n1)c1cc(=O)c2ccccc2o1.
What is the InChIKey of N-[(6-hydroxyimidazo[1,2-a]pyridin-2-yl)methyl]-4-oxochromene-2-carboxamide?
The InChIKey is IRFQPQJRZMSEAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13N3O4/c22-12-5-6-17-20-11(9-21(17)10-12)8-19-18(24)16-7-14(23)13-3-1-2-4-15(13)25-16/h1-7,9-10,22H,8H2,(H,19,24).
What are the key properties of N-[(6-hydroxyimidazo[1,2-a]pyridin-2-yl)methyl]-4-oxochromene-2-carboxamide?
N-[(6-hydroxyimidazo[1,2-a]pyridin-2-yl)methyl]-4-oxochromene-2-carboxamide has a molecular weight of 335.32 g/mol, XLogP of 2.08, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-hydroxyimidazo[1,2-a]pyridin-2-yl)methyl]-4-oxochromene-2-carboxamide is sourced from PubChem (CID 170391703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).