1-(furan-3-carbonyl)-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide

C17H19N3O3 — CID 3620848

IUPAC1-(furan-3-carbonyl)-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide
SMILESO=C(NCc1cccnc1)C1CCCN(C(=O)c2ccoc2)C1
InChIInChI=1S/C17H19N3O3/c21-16(19-10-13-3-1-6-18-9-13)14-4-2-7-20(11-14)17(22)15-5-8-23-12-15/h1,3,5-6,8-9,12,14H,2,4,7,10-11H2,(H,19,21)
InChIKeyFEBRGXVTCYUBHO-UHFFFAOYSA-N
MW313.36 g/mol
LogP1.84
Rot. Bonds4

About 1-(furan-3-carbonyl)-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide

1-(furan-3-carbonyl)-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide (PubChem CID 3620848) has the molecular formula C17H19N3O3 and a molecular weight of 313.36 g/mol. Its IUPAC name is 1-(furan-3-carbonyl)-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name1-(furan-3-carbonyl)-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide
PubChem CID3620848
Molecular FormulaC17H19N3O3
Molecular Weight313.36 g/mol
Exact Mass313.14
IUPAC Name1-(furan-3-carbonyl)-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide
SMILESO=C(NCc1cccnc1)C1CCCN(C(=O)c2ccoc2)C1
InChIInChI=1S/C17H19N3O3/c21-16(19-10-13-3-1-6-18-9-13)14-4-2-7-20(11-14)17(22)15-5-8-23-12-15/h1,3,5-6,8-9,12,14H,2,4,7,10-11H2,(H,19,21)
InChIKeyFEBRGXVTCYUBHO-UHFFFAOYSA-N
XLogP1.84
TPSA75.44 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.36
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3R)-1-(furan-2-carbonyl)-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide
CID 32618175
1-N,1-N-dimethyl-3-N-(pyridin-3-ylmethyl)piperidine-1,3-dicarboxamide
CID 47028623
(3S)-N-ethyl-1-(furan-3-carbonyl)piperidine-3-carboxamide
CID 30830527
1-[1-(pyridine-3-carbonyl)piperidin-4-yl]-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide
CID 70721657
(3R)-N-[[4-(carbamoylamino)phenyl]methyl]-1-(furan-3-carbonyl)piperidine-3-carboxamide
CID 51725834
(3R)-N-benzyl-1-[1-(furan-3-carbonyl)piperidin-4-yl]piperidine-3-carboxamide
CID 26393459
N-(pyridin-3-ylmethyl)cyclopentanecarboxamide
CID 595870
N-(pyridin-3-ylmethyl)cyclobutanecarboxamide
CID 25236359
1-(3,5-dimethylbenzoyl)-N-(2-pyridin-3-ylethyl)piperidine-3-carboxamide
CID 55823393
(3S)-1-[1-(pyridazine-3-carbonyl)piperidin-4-yl]-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide
CID 95552529
(3S)-1-[1-(morpholine-4-carbonyl)piperidin-4-yl]-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide
CID 96575804
methyl (3S)-1-(furan-3-carbonyl)piperidine-3-carboxylate
CID 78919632

Frequently Asked Questions

What is the IUPAC name of 1-(furan-3-carbonyl)-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide?
The IUPAC name of 1-(furan-3-carbonyl)-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide (CID 3620848) is 1-(furan-3-carbonyl)-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide.
What is the SMILES notation for 1-(furan-3-carbonyl)-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide?
The canonical SMILES for 1-(furan-3-carbonyl)-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide is O=C(NCc1cccnc1)C1CCCN(C(=O)c2ccoc2)C1.
What is the InChIKey of 1-(furan-3-carbonyl)-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide?
The InChIKey is FEBRGXVTCYUBHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O3/c21-16(19-10-13-3-1-6-18-9-13)14-4-2-7-20(11-14)17(22)15-5-8-23-12-15/h1,3,5-6,8-9,12,14H,2,4,7,10-11H2,(H,19,21).
What are the key properties of 1-(furan-3-carbonyl)-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide?
1-(furan-3-carbonyl)-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide has a molecular weight of 313.36 g/mol, XLogP of 1.84, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-3-carbonyl)-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide is sourced from PubChem (CID 3620848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).