3-(4-chloro-3-hydroxyanilino)-N-(pyridin-3-ylmethyl)furo[2,3-c]pyridine-2-carboxamide

C20H15ClN4O3 — CID 58826957

IUPAC3-(4-chloro-3-hydroxyanilino)-N-(pyridin-3-ylmethyl)furo[2,3-c]pyridine-2-carboxamide
SMILESO=C(NCc1cccnc1)c1oc2cnccc2c1Nc1ccc(Cl)c(O)c1
InChIInChI=1S/C20H15ClN4O3/c21-15-4-3-13(8-16(15)26)25-18-14-5-7-23-11-17(14)28-19(18)20(27)24-10-12-2-1-6-22-9-12/h1-9,11,25-26H,10H2,(H,24,27)
InChIKeyFNHYLVXTMXGQAI-UHFFFAOYSA-N
MW394.82 g/mol
LogP4.26
Rot. Bonds5

About 3-(4-chloro-3-hydroxyanilino)-N-(pyridin-3-ylmethyl)furo[2,3-c]pyridine-2-carboxamide

3-(4-chloro-3-hydroxyanilino)-N-(pyridin-3-ylmethyl)furo[2,3-c]pyridine-2-carboxamide (PubChem CID 58826957) has the molecular formula C20H15ClN4O3 and a molecular weight of 394.82 g/mol. Its IUPAC name is 3-(4-chloro-3-hydroxyanilino)-N-(pyridin-3-ylmethyl)furo[2,3-c]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-(4-chloro-3-hydroxyanilino)-N-(pyridin-3-ylmethyl)furo[2,3-c]pyridine-2-carboxamide
PubChem CID58826957
Molecular FormulaC20H15ClN4O3
Molecular Weight394.82 g/mol
Exact Mass394.08
IUPAC Name3-(4-chloro-3-hydroxyanilino)-N-(pyridin-3-ylmethyl)furo[2,3-c]pyridine-2-carboxamide
SMILESO=C(NCc1cccnc1)c1oc2cnccc2c1Nc1ccc(Cl)c(O)c1
InChIInChI=1S/C20H15ClN4O3/c21-15-4-3-13(8-16(15)26)25-18-14-5-7-23-11-17(14)28-19(18)20(27)24-10-12-2-1-6-22-9-12/h1-9,11,25-26H,10H2,(H,24,27)
InChIKeyFNHYLVXTMXGQAI-UHFFFAOYSA-N
XLogP4.26
TPSA100.28 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.82
LogP ≤ 54.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

5-(3,4-dichloroanilino)-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide
CID 109191293
4-(3,4-dichloroanilino)-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide
CID 109213080
3-[(1-nitroso-2,3-dihydro-1H-inden-5-yl)amino]-N-(pyrimidin-2-ylmethyl)furo[2,3-c]pyridine-2-carboxamide
CID 91137476
2-chloro-N-(pyridin-3-ylmethyl)benzamide
CID 669068
5-bromo-N-(pyridin-3-ylmethyl)furan-2-carboxamide
CID 750404
4-N-(3-chloro-4-methylphenyl)-1-N-(pyridin-3-ylmethyl)benzene-1,4-dicarboxamide
CID 109047684
4-N-(3-chloro-4-fluorophenyl)-1-N-(pyridin-3-ylmethyl)benzene-1,4-dicarboxamide
CID 109047685
5-chloro-N-(pyridin-3-ylmethyl)naphthalene-1-carboxamide
CID 2995794
N-(3,4-dichlorophenyl)-2-pyrimidin-2-ylfuro[2,3-c]pyridin-3-amine
CID 58826816
N-(3,4-dichlorophenyl)-2,2-dimethyl-N'-(pyridin-3-ylmethyl)propanediamide
CID 108963625
5-(2,5-dichloroanilino)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 109235330
7-chloro-2-methyl-N-(pyridin-3-ylmethyl)-1H-indole-3-carboxamide
CID 110852044

Frequently Asked Questions

What is the IUPAC name of 3-(4-chloro-3-hydroxyanilino)-N-(pyridin-3-ylmethyl)furo[2,3-c]pyridine-2-carboxamide?
The IUPAC name of 3-(4-chloro-3-hydroxyanilino)-N-(pyridin-3-ylmethyl)furo[2,3-c]pyridine-2-carboxamide (CID 58826957) is 3-(4-chloro-3-hydroxyanilino)-N-(pyridin-3-ylmethyl)furo[2,3-c]pyridine-2-carboxamide.
What is the SMILES notation for 3-(4-chloro-3-hydroxyanilino)-N-(pyridin-3-ylmethyl)furo[2,3-c]pyridine-2-carboxamide?
The canonical SMILES for 3-(4-chloro-3-hydroxyanilino)-N-(pyridin-3-ylmethyl)furo[2,3-c]pyridine-2-carboxamide is O=C(NCc1cccnc1)c1oc2cnccc2c1Nc1ccc(Cl)c(O)c1.
What is the InChIKey of 3-(4-chloro-3-hydroxyanilino)-N-(pyridin-3-ylmethyl)furo[2,3-c]pyridine-2-carboxamide?
The InChIKey is FNHYLVXTMXGQAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15ClN4O3/c21-15-4-3-13(8-16(15)26)25-18-14-5-7-23-11-17(14)28-19(18)20(27)24-10-12-2-1-6-22-9-12/h1-9,11,25-26H,10H2,(H,24,27).
What are the key properties of 3-(4-chloro-3-hydroxyanilino)-N-(pyridin-3-ylmethyl)furo[2,3-c]pyridine-2-carboxamide?
3-(4-chloro-3-hydroxyanilino)-N-(pyridin-3-ylmethyl)furo[2,3-c]pyridine-2-carboxamide has a molecular weight of 394.82 g/mol, XLogP of 4.26, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chloro-3-hydroxyanilino)-N-(pyridin-3-ylmethyl)furo[2,3-c]pyridine-2-carboxamide is sourced from PubChem (CID 58826957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).