N-(furan-2-ylmethyl)-5-(quinolin-8-ylamino)pyridine-3-carboxamide

C20H16N4O2 — CID 109231433

IUPACN-(furan-2-ylmethyl)-5-(quinolin-8-ylamino)pyridine-3-carboxamide
SMILESO=C(NCc1ccco1)c1cncc(Nc2cccc3cccnc23)c1
InChIInChI=1S/C20H16N4O2/c25-20(23-13-17-6-3-9-26-17)15-10-16(12-21-11-15)24-18-7-1-4-14-5-2-8-22-19(14)18/h1-12,24H,13H2,(H,23,25)
InChIKeyZYCFGMDAZHNHNN-UHFFFAOYSA-N
MW344.37 g/mol
LogP3.90
Rot. Bonds5

About N-(furan-2-ylmethyl)-5-(quinolin-8-ylamino)pyridine-3-carboxamide

N-(furan-2-ylmethyl)-5-(quinolin-8-ylamino)pyridine-3-carboxamide (PubChem CID 109231433) has the molecular formula C20H16N4O2 and a molecular weight of 344.37 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-5-(quinolin-8-ylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-5-(quinolin-8-ylamino)pyridine-3-carboxamide
PubChem CID109231433
Molecular FormulaC20H16N4O2
Molecular Weight344.37 g/mol
Exact Mass344.13
IUPAC NameN-(furan-2-ylmethyl)-5-(quinolin-8-ylamino)pyridine-3-carboxamide
SMILESO=C(NCc1ccco1)c1cncc(Nc2cccc3cccnc23)c1
InChIInChI=1S/C20H16N4O2/c25-20(23-13-17-6-3-9-26-17)15-10-16(12-21-11-15)24-18-7-1-4-14-5-2-8-22-19(14)18/h1-12,24H,13H2,(H,23,25)
InChIKeyZYCFGMDAZHNHNN-UHFFFAOYSA-N
XLogP3.90
TPSA80.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.37
LogP ≤ 53.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-N-(furan-2-ylmethyl)-4-N-quinolin-8-ylbenzene-1,4-dicarboxamide
CID 109046640
5-(2,3-dichloroanilino)-N-(furan-2-ylmethyl)pyridine-3-carboxamide
CID 109231446
5-(quinolin-8-ylamino)pyridine-3-carboxylic acid
CID 82535032
N-tert-butyl-5-(quinolin-8-ylamino)pyridine-3-carboxamide
CID 109239349
N-(2-ethylphenyl)-5-(quinolin-8-ylamino)pyridine-3-carboxamide
CID 109243373
N-(furan-2-ylmethyl)-5-hydroxypyridine-3-carboxamide
CID 63864753
N,N-dipropyl-5-(quinolin-8-ylamino)pyridine-3-carboxamide
CID 109240993
5-(cyclopentylamino)-N-(furan-2-ylmethyl)pyridine-3-carboxamide
CID 109226082
N-(furan-2-ylmethyl)-5-(2,4,6-trimethylanilino)pyridine-3-carboxamide
CID 109231371
N-(3,4-dimethylphenyl)-5-(quinolin-8-ylamino)pyridine-3-carboxamide
CID 109242937
N-(furan-2-ylmethyl)pyridine-3-carboxamide
CID 1087305
N-(3-cyanophenyl)-5-(quinolin-8-ylamino)pyridine-3-carboxamide
CID 109246222

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-5-(quinolin-8-ylamino)pyridine-3-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)-5-(quinolin-8-ylamino)pyridine-3-carboxamide (CID 109231433) is N-(furan-2-ylmethyl)-5-(quinolin-8-ylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-5-(quinolin-8-ylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)-5-(quinolin-8-ylamino)pyridine-3-carboxamide is O=C(NCc1ccco1)c1cncc(Nc2cccc3cccnc23)c1.
What is the InChIKey of N-(furan-2-ylmethyl)-5-(quinolin-8-ylamino)pyridine-3-carboxamide?
The InChIKey is ZYCFGMDAZHNHNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N4O2/c25-20(23-13-17-6-3-9-26-17)15-10-16(12-21-11-15)24-18-7-1-4-14-5-2-8-22-19(14)18/h1-12,24H,13H2,(H,23,25).
What are the key properties of N-(furan-2-ylmethyl)-5-(quinolin-8-ylamino)pyridine-3-carboxamide?
N-(furan-2-ylmethyl)-5-(quinolin-8-ylamino)pyridine-3-carboxamide has a molecular weight of 344.37 g/mol, XLogP of 3.90, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-5-(quinolin-8-ylamino)pyridine-3-carboxamide is sourced from PubChem (CID 109231433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).