N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]cyclopropanecarboxamide

C15H21N3O — CID 37476276

IUPACN-[1-(pyridin-2-ylmethyl)piperidin-4-yl]cyclopropanecarboxamide
SMILESO=C(NC1CCN(Cc2ccccn2)CC1)C1CC1
InChIInChI=1S/C15H21N3O/c19-15(12-4-5-12)17-13-6-9-18(10-7-13)11-14-3-1-2-8-16-14/h1-3,8,12-13H,4-7,9-11H2,(H,17,19)
InChIKeyFXFPYGNTTATQNF-UHFFFAOYSA-N
MW259.35 g/mol
LogP1.57
Rot. Bonds4

About N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]cyclopropanecarboxamide

N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]cyclopropanecarboxamide (PubChem CID 37476276) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[1-(pyridin-2-ylmethyl)piperidin-4-yl]cyclopropanecarboxamide
PubChem CID37476276
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC NameN-[1-(pyridin-2-ylmethyl)piperidin-4-yl]cyclopropanecarboxamide
SMILESO=C(NC1CCN(Cc2ccccn2)CC1)C1CC1
InChIInChI=1S/C15H21N3O/c19-15(12-4-5-12)17-13-6-9-18(10-7-13)11-14-3-1-2-8-16-14/h1-3,8,12-13H,4-7,9-11H2,(H,17,19)
InChIKeyFXFPYGNTTATQNF-UHFFFAOYSA-N
XLogP1.57
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(pyridin-2-ylmethyl)piperidin-4-yl]urea;dihydrochloride
CID 174440638
2-(cyclopropylmethylamino)-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]acetamide
CID 119901369
3-amino-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]bicyclo[2.2.1]heptane-2-carboxamide
CID 119901353
1-[(2-chloro-3-pyridinyl)sulfonyl]-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]piperidine-4-carboxamide
CID 55859758
1-cyclopentyl-3-[1-(pyridin-2-ylmethyl)piperidin-4-yl]thiourea
CID 100572605
N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]thiophene-2-carboxamide
CID 51087555
1-cyclobutyl-2-methyl-3-[1-(pyridin-2-ylmethyl)piperidin-4-yl]guanidine;hydroiodide
CID 119153797
4-N-cyclopropyl-1-N-(pyridin-2-ylmethyl)cyclohexane-1,4-dicarboxamide
CID 109144683
1-(4-fluorophenyl)sulfonyl-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]piperidine-3-carboxamide
CID 55859239
2-oxo-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]-1-oxaspiro[4.5]decane-4-carboxamide
CID 74230828
N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide
CID 55857840
2,4-dichloro-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]benzamide
CID 47058964

Frequently Asked Questions

What is the IUPAC name of N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]cyclopropanecarboxamide?
The IUPAC name of N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]cyclopropanecarboxamide (CID 37476276) is N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]cyclopropanecarboxamide.
What is the SMILES notation for N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]cyclopropanecarboxamide?
The canonical SMILES for N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]cyclopropanecarboxamide is O=C(NC1CCN(Cc2ccccn2)CC1)C1CC1.
What is the InChIKey of N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]cyclopropanecarboxamide?
The InChIKey is FXFPYGNTTATQNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c19-15(12-4-5-12)17-13-6-9-18(10-7-13)11-14-3-1-2-8-16-14/h1-3,8,12-13H,4-7,9-11H2,(H,17,19).
What are the key properties of N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]cyclopropanecarboxamide?
N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]cyclopropanecarboxamide has a molecular weight of 259.35 g/mol, XLogP of 1.57, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]cyclopropanecarboxamide is sourced from PubChem (CID 37476276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).