2-N-cyclopentyl-4-N-(furan-2-ylmethyl)pyridine-2,4-dicarboxamide

C17H19N3O3 — CID 109080870

IUPAC2-N-cyclopentyl-4-N-(furan-2-ylmethyl)pyridine-2,4-dicarboxamide
SMILESO=C(NCc1ccco1)c1ccnc(C(=O)NC2CCCC2)c1
InChIInChI=1S/C17H19N3O3/c21-16(19-11-14-6-3-9-23-14)12-7-8-18-15(10-12)17(22)20-13-4-1-2-5-13/h3,6-10,13H,1-2,4-5,11H2,(H,19,21)(H,20,22)
InChIKeyOAUHNXPMMZVWHF-UHFFFAOYSA-N
MW313.36 g/mol
LogP2.28
Rot. Bonds5

About 2-N-cyclopentyl-4-N-(furan-2-ylmethyl)pyridine-2,4-dicarboxamide

2-N-cyclopentyl-4-N-(furan-2-ylmethyl)pyridine-2,4-dicarboxamide (PubChem CID 109080870) has the molecular formula C17H19N3O3 and a molecular weight of 313.36 g/mol. Its IUPAC name is 2-N-cyclopentyl-4-N-(furan-2-ylmethyl)pyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name2-N-cyclopentyl-4-N-(furan-2-ylmethyl)pyridine-2,4-dicarboxamide
PubChem CID109080870
Molecular FormulaC17H19N3O3
Molecular Weight313.36 g/mol
Exact Mass313.14
IUPAC Name2-N-cyclopentyl-4-N-(furan-2-ylmethyl)pyridine-2,4-dicarboxamide
SMILESO=C(NCc1ccco1)c1ccnc(C(=O)NC2CCCC2)c1
InChIInChI=1S/C17H19N3O3/c21-16(19-11-14-6-3-9-23-14)12-7-8-18-15(10-12)17(22)20-13-4-1-2-5-13/h3,6-10,13H,1-2,4-5,11H2,(H,19,21)(H,20,22)
InChIKeyOAUHNXPMMZVWHF-UHFFFAOYSA-N
XLogP2.28
TPSA84.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.36
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-N-cyclopentyl-3-N-(furan-2-ylmethyl)pyridine-3,5-dicarboxamide
CID 109102679
4-N-(furan-2-ylmethyl)-2-N-(oxolan-2-ylmethyl)pyridine-2,4-dicarboxamide
CID 109083258
N-cyclopropyl-4-(furan-2-ylmethylamino)pyridine-2-carboxamide
CID 109201702
2-N-[2-(cyclohexen-1-yl)ethyl]-4-N-(furan-2-ylmethyl)pyridine-2,4-dicarboxamide
CID 109082049
N-cyclopentyl-6-(furan-2-ylmethylamino)pyrimidine-4-carboxamide
CID 109341395
4-(2-ethylpiperidine-1-carbonyl)-N-(furan-2-ylmethyl)pyridine-2-carboxamide
CID 109085186
2-N-[(2-fluorophenyl)methyl]-4-N-(furan-2-ylmethyl)pyridine-2,4-dicarboxamide
CID 109085013
4-N-butyl-2-N-cyclopentylpyridine-2,4-dicarboxamide
CID 109079185
2-N-cyclopropyl-4-N-(pyridin-4-ylmethyl)pyridine-2,4-dicarboxamide
CID 109078635
2-N-cyclohexyl-4-N-[(4-methoxyphenyl)methyl]pyridine-2,4-dicarboxamide
CID 109081527
2-N-(4-acetylphenyl)-4-N-(furan-2-ylmethyl)pyridine-2,4-dicarboxamide
CID 109085109
4-N-(furan-2-ylmethyl)-2-N-(4-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109085096

Frequently Asked Questions

What is the IUPAC name of 2-N-cyclopentyl-4-N-(furan-2-ylmethyl)pyridine-2,4-dicarboxamide?
The IUPAC name of 2-N-cyclopentyl-4-N-(furan-2-ylmethyl)pyridine-2,4-dicarboxamide (CID 109080870) is 2-N-cyclopentyl-4-N-(furan-2-ylmethyl)pyridine-2,4-dicarboxamide.
What is the SMILES notation for 2-N-cyclopentyl-4-N-(furan-2-ylmethyl)pyridine-2,4-dicarboxamide?
The canonical SMILES for 2-N-cyclopentyl-4-N-(furan-2-ylmethyl)pyridine-2,4-dicarboxamide is O=C(NCc1ccco1)c1ccnc(C(=O)NC2CCCC2)c1.
What is the InChIKey of 2-N-cyclopentyl-4-N-(furan-2-ylmethyl)pyridine-2,4-dicarboxamide?
The InChIKey is OAUHNXPMMZVWHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O3/c21-16(19-11-14-6-3-9-23-14)12-7-8-18-15(10-12)17(22)20-13-4-1-2-5-13/h3,6-10,13H,1-2,4-5,11H2,(H,19,21)(H,20,22).
What are the key properties of 2-N-cyclopentyl-4-N-(furan-2-ylmethyl)pyridine-2,4-dicarboxamide?
2-N-cyclopentyl-4-N-(furan-2-ylmethyl)pyridine-2,4-dicarboxamide has a molecular weight of 313.36 g/mol, XLogP of 2.28, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-cyclopentyl-4-N-(furan-2-ylmethyl)pyridine-2,4-dicarboxamide is sourced from PubChem (CID 109080870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).