N-(furan-2-ylmethyl)-2-(propylamino)pyridine-4-carboxamide

C14H17N3O2 — CID 62172710

IUPACN-(furan-2-ylmethyl)-2-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cc(C(=O)NCc2ccco2)ccn1
InChIInChI=1S/C14H17N3O2/c1-2-6-15-13-9-11(5-7-16-13)14(18)17-10-12-4-3-8-19-12/h3-5,7-9H,2,6,10H2,1H3,(H,15,16)(H,17,18)
InChIKeyUQRDBDIIYMVVKO-UHFFFAOYSA-N
MW259.31 g/mol
LogP2.43
Rot. Bonds6

About N-(furan-2-ylmethyl)-2-(propylamino)pyridine-4-carboxamide

N-(furan-2-ylmethyl)-2-(propylamino)pyridine-4-carboxamide (PubChem CID 62172710) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-2-(propylamino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-2-(propylamino)pyridine-4-carboxamide
PubChem CID62172710
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC NameN-(furan-2-ylmethyl)-2-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cc(C(=O)NCc2ccco2)ccn1
InChIInChI=1S/C14H17N3O2/c1-2-6-15-13-9-11(5-7-16-13)14(18)17-10-12-4-3-8-19-12/h3-5,7-9H,2,6,10H2,1H3,(H,15,16)(H,17,18)
InChIKeyUQRDBDIIYMVVKO-UHFFFAOYSA-N
XLogP2.43
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(furan-2-ylmethyl)-2-[2-(3-methoxyphenyl)ethylamino]pyridine-4-carboxamide
CID 109169233
N-butyl-2-(propylamino)pyridine-4-carboxamide
CID 62185279
2-(3-bromo-4-methylanilino)-N-(furan-2-ylmethyl)pyridine-4-carboxamide
CID 109169271
N-(2,2-dimethylpropyl)-2-(propylamino)pyridine-4-carboxamide
CID 62179912
N-methyl-2-(propylamino)pyridine-4-carboxamide
CID 62170975
2-(furan-2-ylmethylamino)-N-[2-(2-methoxyphenyl)ethyl]pyridine-4-carboxamide
CID 109169326
1-N,3-N-bis(furan-2-ylmethyl)benzene-1,3-dicarboxamide
CID 743261
N-[(2-methyl-1,3-thiazol-4-yl)methyl]-2-(propylamino)pyridine-4-carboxamide
CID 62174606
N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-(propylamino)pyridine-4-carboxamide
CID 62178161
N-[2-(diethylamino)ethyl]-2-(propylamino)pyridine-4-carboxamide
CID 62173284
N-(4-amino-4-oxobutyl)-2-(propylamino)pyridine-4-carboxamide
CID 55046885
N-(2-methylbutyl)-2-(propylamino)pyridine-4-carboxamide
CID 62694218

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-2-(propylamino)pyridine-4-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)-2-(propylamino)pyridine-4-carboxamide (CID 62172710) is N-(furan-2-ylmethyl)-2-(propylamino)pyridine-4-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-2-(propylamino)pyridine-4-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)-2-(propylamino)pyridine-4-carboxamide is CCCNc1cc(C(=O)NCc2ccco2)ccn1.
What is the InChIKey of N-(furan-2-ylmethyl)-2-(propylamino)pyridine-4-carboxamide?
The InChIKey is UQRDBDIIYMVVKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-2-6-15-13-9-11(5-7-16-13)14(18)17-10-12-4-3-8-19-12/h3-5,7-9H,2,6,10H2,1H3,(H,15,16)(H,17,18).
What are the key properties of N-(furan-2-ylmethyl)-2-(propylamino)pyridine-4-carboxamide?
N-(furan-2-ylmethyl)-2-(propylamino)pyridine-4-carboxamide has a molecular weight of 259.31 g/mol, XLogP of 2.43, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-2-(propylamino)pyridine-4-carboxamide is sourced from PubChem (CID 62172710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).