N-pyridin-2-yl-1-(2H-triazol-4-ylmethyl)piperidine-3-carboxamide

C14H18N6O — CID 154802595

IUPACN-pyridin-2-yl-1-(2H-triazol-4-ylmethyl)piperidine-3-carboxamide
SMILESO=C(Nc1ccccn1)C1CCCN(Cc2cn[nH]n2)C1
InChIInChI=1S/C14H18N6O/c21-14(17-13-5-1-2-6-15-13)11-4-3-7-20(9-11)10-12-8-16-19-18-12/h1-2,5-6,8,11H,3-4,7,9-10H2,(H,15,17,21)(H,16,18,19)
InChIKeyCTZUZZWOXQOOEQ-UHFFFAOYSA-N
MW286.34 g/mol
LogP1.05
Rot. Bonds4

About N-pyridin-2-yl-1-(2H-triazol-4-ylmethyl)piperidine-3-carboxamide

N-pyridin-2-yl-1-(2H-triazol-4-ylmethyl)piperidine-3-carboxamide (PubChem CID 154802595) has the molecular formula C14H18N6O and a molecular weight of 286.34 g/mol. Its IUPAC name is N-pyridin-2-yl-1-(2H-triazol-4-ylmethyl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN-pyridin-2-yl-1-(2H-triazol-4-ylmethyl)piperidine-3-carboxamide
PubChem CID154802595
Molecular FormulaC14H18N6O
Molecular Weight286.34 g/mol
Exact Mass286.15
IUPAC NameN-pyridin-2-yl-1-(2H-triazol-4-ylmethyl)piperidine-3-carboxamide
SMILESO=C(Nc1ccccn1)C1CCCN(Cc2cn[nH]n2)C1
InChIInChI=1S/C14H18N6O/c21-14(17-13-5-1-2-6-15-13)11-4-3-7-20(9-11)10-12-8-16-19-18-12/h1-2,5-6,8,11H,3-4,7,9-10H2,(H,15,17,21)(H,16,18,19)
InChIKeyCTZUZZWOXQOOEQ-UHFFFAOYSA-N
XLogP1.05
TPSA86.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.34
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(3R)-N-(5-chloro-2-pyridinyl)-1-(pyridin-2-ylmethyl)piperidine-3-carboxamide
CID 95282049
(3R)-N-(6-methyl-2-pyridinyl)-1-(pyridin-2-ylmethyl)piperidine-3-carboxamide
CID 95139642
1-benzyl-N-(5-ethyl-1H-pyrazol-3-yl)piperidine-3-carboxamide
CID 48508171
(3S)-3-N-pyridin-2-ylpiperidine-1,3-dicarboxamide
CID 51927409
1-benzyl-N-(5-chloro-2-pyridinyl)piperidine-3-carboxamide
CID 60565468
(3S)-N-(5-chloro-2-pyridinyl)-1-(2-pyridin-2-ylethyl)piperidine-3-carboxamide
CID 95339286
ethyl 3-(pyridin-2-ylcarbamoyl)piperidine-1-carboxylate
CID 46578071
azepan-1-yl-[1-(pyridin-2-ylmethyl)piperidin-3-yl]methanone
CID 5116844
N-pyridin-2-yl-1-(1-pyrimidin-2-ylpiperidine-3-carbonyl)piperidine-4-carboxamide
CID 55808596
1-[[2-(2-chlorophenyl)-1,3-thiazol-4-yl]methyl]-N-(5-chloro-2-pyridinyl)piperidine-3-carboxamide
CID 55995028
(3R)-3-N-cyclohexyl-1-N-pyridin-2-ylpiperidine-1,3-dicarboxamide
CID 95154562
2-piperidin-1-yl-N-pyridin-2-ylacetamide
CID 12780526

Frequently Asked Questions

What is the IUPAC name of N-pyridin-2-yl-1-(2H-triazol-4-ylmethyl)piperidine-3-carboxamide?
The IUPAC name of N-pyridin-2-yl-1-(2H-triazol-4-ylmethyl)piperidine-3-carboxamide (CID 154802595) is N-pyridin-2-yl-1-(2H-triazol-4-ylmethyl)piperidine-3-carboxamide.
What is the SMILES notation for N-pyridin-2-yl-1-(2H-triazol-4-ylmethyl)piperidine-3-carboxamide?
The canonical SMILES for N-pyridin-2-yl-1-(2H-triazol-4-ylmethyl)piperidine-3-carboxamide is O=C(Nc1ccccn1)C1CCCN(Cc2cn[nH]n2)C1.
What is the InChIKey of N-pyridin-2-yl-1-(2H-triazol-4-ylmethyl)piperidine-3-carboxamide?
The InChIKey is CTZUZZWOXQOOEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N6O/c21-14(17-13-5-1-2-6-15-13)11-4-3-7-20(9-11)10-12-8-16-19-18-12/h1-2,5-6,8,11H,3-4,7,9-10H2,(H,15,17,21)(H,16,18,19).
What are the key properties of N-pyridin-2-yl-1-(2H-triazol-4-ylmethyl)piperidine-3-carboxamide?
N-pyridin-2-yl-1-(2H-triazol-4-ylmethyl)piperidine-3-carboxamide has a molecular weight of 286.34 g/mol, XLogP of 1.05, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyridin-2-yl-1-(2H-triazol-4-ylmethyl)piperidine-3-carboxamide is sourced from PubChem (CID 154802595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).