N-(furan-2-ylmethyl)-2-pyridin-4-ylquinoline-4-carboxamide

C20H15N3O2 — CID 3241370

IUPACN-(furan-2-ylmethyl)-2-pyridin-4-ylquinoline-4-carboxamide
SMILESO=C(NCc1ccco1)c1cc(-c2ccncc2)nc2ccccc12
InChIInChI=1S/C20H15N3O2/c24-20(22-13-15-4-3-11-25-15)17-12-19(14-7-9-21-10-8-14)23-18-6-2-1-5-16(17)18/h1-12H,13H2,(H,22,24)
InChIKeyBBCANISUVWZIAE-UHFFFAOYSA-N
MW329.36 g/mol
LogP3.82
Rot. Bonds4

About N-(furan-2-ylmethyl)-2-pyridin-4-ylquinoline-4-carboxamide

N-(furan-2-ylmethyl)-2-pyridin-4-ylquinoline-4-carboxamide (PubChem CID 3241370) has the molecular formula C20H15N3O2 and a molecular weight of 329.36 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-2-pyridin-4-ylquinoline-4-carboxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-2-pyridin-4-ylquinoline-4-carboxamide
PubChem CID3241370
Molecular FormulaC20H15N3O2
Molecular Weight329.36 g/mol
Exact Mass329.12
IUPAC NameN-(furan-2-ylmethyl)-2-pyridin-4-ylquinoline-4-carboxamide
SMILESO=C(NCc1ccco1)c1cc(-c2ccncc2)nc2ccccc12
InChIInChI=1S/C20H15N3O2/c24-20(22-13-15-4-3-11-25-15)17-12-19(14-7-9-21-10-8-14)23-18-6-2-1-5-16(17)18/h1-12H,13H2,(H,22,24)
InChIKeyBBCANISUVWZIAE-UHFFFAOYSA-N
XLogP3.82
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.36
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(furan-2-ylmethyl)-2-phenylquinoline-4-carboxamide
CID 2188237
N-(furan-2-ylmethyl)-2-(4-methylphenyl)quinoline-4-carboxamide
CID 856014
N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-2-phenylquinoline-4-carboxamide
CID 9079005
N-benzyl-2-pyridin-4-ylquinoline-4-carboxamide
CID 757748
2-(4-fluorophenyl)-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]quinoline-4-carboxamide
CID 9079495
N-[(4-hydroxyphenyl)methyl]-2-pyridin-4-ylquinoline-4-carboxamide
CID 46539313
N-[(5-methylthiophen-2-yl)methyl]-2-pyridin-4-ylquinoline-4-carboxamide
CID 55794770
N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-2-thiophen-2-ylquinoline-4-carboxamide
CID 9080200
N-[[4-[(dimethylamino)methyl]phenyl]methyl]-2-pyridin-4-ylquinoline-4-carboxamide
CID 26132145
N-[(2-methyl-1,3-thiazol-4-yl)methyl]-2-pyridin-4-ylquinoline-4-carboxamide
CID 72868649
2-(4-hydroxyphenyl)-N-(1,3-oxazol-5-ylmethyl)quinoline-4-carboxamide
CID 166385963
N-(2-phenylethyl)-2-pyridin-4-ylquinoline-4-carboxamide
CID 4082729

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-2-pyridin-4-ylquinoline-4-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)-2-pyridin-4-ylquinoline-4-carboxamide (CID 3241370) is N-(furan-2-ylmethyl)-2-pyridin-4-ylquinoline-4-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-2-pyridin-4-ylquinoline-4-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)-2-pyridin-4-ylquinoline-4-carboxamide is O=C(NCc1ccco1)c1cc(-c2ccncc2)nc2ccccc12.
What is the InChIKey of N-(furan-2-ylmethyl)-2-pyridin-4-ylquinoline-4-carboxamide?
The InChIKey is BBCANISUVWZIAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N3O2/c24-20(22-13-15-4-3-11-25-15)17-12-19(14-7-9-21-10-8-14)23-18-6-2-1-5-16(17)18/h1-12H,13H2,(H,22,24).
What are the key properties of N-(furan-2-ylmethyl)-2-pyridin-4-ylquinoline-4-carboxamide?
N-(furan-2-ylmethyl)-2-pyridin-4-ylquinoline-4-carboxamide has a molecular weight of 329.36 g/mol, XLogP of 3.82, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-2-pyridin-4-ylquinoline-4-carboxamide is sourced from PubChem (CID 3241370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).