N-(pyridin-4-ylmethyl)furan-3-carboxamide

C11H10N2O2 — CID 16729507

IUPACN-(pyridin-4-ylmethyl)furan-3-carboxamide
SMILESO=C(NCc1ccncc1)c1ccoc1
InChIInChI=1S/C11H10N2O2/c14-11(10-3-6-15-8-10)13-7-9-1-4-12-5-2-9/h1-6,8H,7H2,(H,13,14)
InChIKeyJGUAGRTWVKMTMF-UHFFFAOYSA-N
MW202.21 g/mol
LogP1.60
Rot. Bonds3

About N-(pyridin-4-ylmethyl)furan-3-carboxamide

N-(pyridin-4-ylmethyl)furan-3-carboxamide (PubChem CID 16729507) has the molecular formula C11H10N2O2 and a molecular weight of 202.21 g/mol. Its IUPAC name is N-(pyridin-4-ylmethyl)furan-3-carboxamide.

Molecular Properties

Compound NameN-(pyridin-4-ylmethyl)furan-3-carboxamide
PubChem CID16729507
Molecular FormulaC11H10N2O2
Molecular Weight202.21 g/mol
Exact Mass202.07
IUPAC NameN-(pyridin-4-ylmethyl)furan-3-carboxamide
SMILESO=C(NCc1ccncc1)c1ccoc1
InChIInChI=1S/C11H10N2O2/c14-11(10-3-6-15-8-10)13-7-9-1-4-12-5-2-9/h1-6,8H,7H2,(H,13,14)
InChIKeyJGUAGRTWVKMTMF-UHFFFAOYSA-N
XLogP1.60
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.21
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(pyridin-4-ylmethyl)furan-3-carboxamide?
The IUPAC name of N-(pyridin-4-ylmethyl)furan-3-carboxamide (CID 16729507) is N-(pyridin-4-ylmethyl)furan-3-carboxamide.
What is the SMILES notation for N-(pyridin-4-ylmethyl)furan-3-carboxamide?
The canonical SMILES for N-(pyridin-4-ylmethyl)furan-3-carboxamide is O=C(NCc1ccncc1)c1ccoc1.
What is the InChIKey of N-(pyridin-4-ylmethyl)furan-3-carboxamide?
The InChIKey is JGUAGRTWVKMTMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O2/c14-11(10-3-6-15-8-10)13-7-9-1-4-12-5-2-9/h1-6,8H,7H2,(H,13,14).
What are the key properties of N-(pyridin-4-ylmethyl)furan-3-carboxamide?
N-(pyridin-4-ylmethyl)furan-3-carboxamide has a molecular weight of 202.21 g/mol, XLogP of 1.60, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(pyridin-4-ylmethyl)furan-3-carboxamide is sourced from PubChem (CID 16729507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).