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

C20H15N3O2 — CID 757630

IUPACN-(furan-2-ylmethyl)-2-pyridin-2-ylquinoline-4-carboxamide
SMILESO=C(NCc1ccco1)c1cc(-c2ccccn2)nc2ccccc12
InChIInChI=1S/C20H15N3O2/c24-20(22-13-14-6-5-11-25-14)16-12-19(18-9-3-4-10-21-18)23-17-8-2-1-7-15(16)17/h1-12H,13H2,(H,22,24)
InChIKeyFUAVTAZQSFGXPM-UHFFFAOYSA-N
MW329.36 g/mol
LogP3.82
Rot. Bonds4

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

N-(furan-2-ylmethyl)-2-pyridin-2-ylquinoline-4-carboxamide (PubChem CID 757630) has the molecular formula C20H15N3O2 and a molecular weight of 329.36 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-2-pyridin-2-ylquinoline-4-carboxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-2-pyridin-2-ylquinoline-4-carboxamide
PubChem CID757630
Molecular FormulaC20H15N3O2
Molecular Weight329.36 g/mol
Exact Mass329.12
IUPAC NameN-(furan-2-ylmethyl)-2-pyridin-2-ylquinoline-4-carboxamide
SMILESO=C(NCc1ccco1)c1cc(-c2ccccn2)nc2ccccc12
InChIInChI=1S/C20H15N3O2/c24-20(22-13-14-6-5-11-25-14)16-12-19(18-9-3-4-10-21-18)23-17-8-2-1-7-15(16)17/h1-12H,13H2,(H,22,24)
InChIKeyFUAVTAZQSFGXPM-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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Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-2-pyridin-2-ylquinoline-4-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)-2-pyridin-2-ylquinoline-4-carboxamide (CID 757630) is N-(furan-2-ylmethyl)-2-pyridin-2-ylquinoline-4-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-2-pyridin-2-ylquinoline-4-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)-2-pyridin-2-ylquinoline-4-carboxamide is O=C(NCc1ccco1)c1cc(-c2ccccn2)nc2ccccc12.
What is the InChIKey of N-(furan-2-ylmethyl)-2-pyridin-2-ylquinoline-4-carboxamide?
The InChIKey is FUAVTAZQSFGXPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N3O2/c24-20(22-13-14-6-5-11-25-14)16-12-19(18-9-3-4-10-21-18)23-17-8-2-1-7-15(16)17/h1-12H,13H2,(H,22,24).
What are the key properties of N-(furan-2-ylmethyl)-2-pyridin-2-ylquinoline-4-carboxamide?
N-(furan-2-ylmethyl)-2-pyridin-2-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-2-ylquinoline-4-carboxamide is sourced from PubChem (CID 757630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).