5-(4-benzylpiperidin-1-yl)-N-cyclopropylpyridine-3-carboxamide

C21H25N3O — CID 109223634

IUPAC5-(4-benzylpiperidin-1-yl)-N-cyclopropylpyridine-3-carboxamide
SMILESO=C(NC1CC1)c1cncc(N2CCC(Cc3ccccc3)CC2)c1
InChIInChI=1S/C21H25N3O/c25-21(23-19-6-7-19)18-13-20(15-22-14-18)24-10-8-17(9-11-24)12-16-4-2-1-3-5-16/h1-5,13-15,17,19H,6-12H2,(H,23,25)
InChIKeyGPAHTYXLRXBRTE-UHFFFAOYSA-N
MW335.45 g/mol
LogP3.43
Rot. Bonds5

About 5-(4-benzylpiperidin-1-yl)-N-cyclopropylpyridine-3-carboxamide

5-(4-benzylpiperidin-1-yl)-N-cyclopropylpyridine-3-carboxamide (PubChem CID 109223634) has the molecular formula C21H25N3O and a molecular weight of 335.45 g/mol. Its IUPAC name is 5-(4-benzylpiperidin-1-yl)-N-cyclopropylpyridine-3-carboxamide.

Molecular Properties

Compound Name5-(4-benzylpiperidin-1-yl)-N-cyclopropylpyridine-3-carboxamide
PubChem CID109223634
Molecular FormulaC21H25N3O
Molecular Weight335.45 g/mol
Exact Mass335.20
IUPAC Name5-(4-benzylpiperidin-1-yl)-N-cyclopropylpyridine-3-carboxamide
SMILESO=C(NC1CC1)c1cncc(N2CCC(Cc3ccccc3)CC2)c1
InChIInChI=1S/C21H25N3O/c25-21(23-19-6-7-19)18-13-20(15-22-14-18)24-10-8-17(9-11-24)12-16-4-2-1-3-5-16/h1-5,13-15,17,19H,6-12H2,(H,23,25)
InChIKeyGPAHTYXLRXBRTE-UHFFFAOYSA-N
XLogP3.43
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.45
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(4-benzylpiperidin-1-yl)pyridine-3-carboxylic acid
CID 82535114
5-(4-benzylpiperidin-1-yl)-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide
CID 109231990
[5-(4-benzylpiperidin-1-yl)-3-pyridinyl]-piperidin-1-ylmethanone
CID 109226329
2-(4-benzylpiperidin-1-yl)-N-cyclopentylpyrimidine-5-carboxamide
CID 109249597
(4-benzylpiperidin-1-yl)-(5-morpholin-4-yl-3-pyridinyl)methanone
CID 109228617
5-(4-benzylpiperidin-1-yl)-N-butyl-N-methylpyridine-3-carboxamide
CID 109240243
N-cyclopentyl-5-piperidin-1-ylpyridine-3-carboxamide
CID 109225879
3-[(4-benzylpiperidin-1-yl)methyl]-N-cyclopropylbenzamide
CID 42850889
4-(4-benzylpiperidin-1-yl)benzoic acid
CID 22730857
5-(4-benzylpiperidin-1-yl)-N-cyclopentylpyrazine-2-carboxamide
CID 109273957
(4-benzylpiperidin-1-yl)-[5-(3-methylpiperidin-1-yl)-3-pyridinyl]methanone
CID 109240472
5-(4-methylpiperazin-1-yl)-N-(2-phenylethyl)pyridine-3-carboxamide
CID 109230257

Frequently Asked Questions

What is the IUPAC name of 5-(4-benzylpiperidin-1-yl)-N-cyclopropylpyridine-3-carboxamide?
The IUPAC name of 5-(4-benzylpiperidin-1-yl)-N-cyclopropylpyridine-3-carboxamide (CID 109223634) is 5-(4-benzylpiperidin-1-yl)-N-cyclopropylpyridine-3-carboxamide.
What is the SMILES notation for 5-(4-benzylpiperidin-1-yl)-N-cyclopropylpyridine-3-carboxamide?
The canonical SMILES for 5-(4-benzylpiperidin-1-yl)-N-cyclopropylpyridine-3-carboxamide is O=C(NC1CC1)c1cncc(N2CCC(Cc3ccccc3)CC2)c1.
What is the InChIKey of 5-(4-benzylpiperidin-1-yl)-N-cyclopropylpyridine-3-carboxamide?
The InChIKey is GPAHTYXLRXBRTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N3O/c25-21(23-19-6-7-19)18-13-20(15-22-14-18)24-10-8-17(9-11-24)12-16-4-2-1-3-5-16/h1-5,13-15,17,19H,6-12H2,(H,23,25).
What are the key properties of 5-(4-benzylpiperidin-1-yl)-N-cyclopropylpyridine-3-carboxamide?
5-(4-benzylpiperidin-1-yl)-N-cyclopropylpyridine-3-carboxamide has a molecular weight of 335.45 g/mol, XLogP of 3.43, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-benzylpiperidin-1-yl)-N-cyclopropylpyridine-3-carboxamide is sourced from PubChem (CID 109223634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).