5-phenyl-N-piperidin-4-yl-N-propylpyridine-3-carboxamide

C20H25N3O — CID 119824704

IUPAC5-phenyl-N-piperidin-4-yl-N-propylpyridine-3-carboxamide
SMILESCCCN(C(=O)c1cncc(-c2ccccc2)c1)C1CCNCC1
InChIInChI=1S/C20H25N3O/c1-2-12-23(19-8-10-21-11-9-19)20(24)18-13-17(14-22-15-18)16-6-4-3-5-7-16/h3-7,13-15,19,21H,2,8-12H2,1H3
InChIKeyOTJQRYIMRXNKKM-UHFFFAOYSA-N
MW323.44 g/mol
LogP3.35
Rot. Bonds5

About 5-phenyl-N-piperidin-4-yl-N-propylpyridine-3-carboxamide

5-phenyl-N-piperidin-4-yl-N-propylpyridine-3-carboxamide (PubChem CID 119824704) has the molecular formula C20H25N3O and a molecular weight of 323.44 g/mol. Its IUPAC name is 5-phenyl-N-piperidin-4-yl-N-propylpyridine-3-carboxamide.

Molecular Properties

Compound Name5-phenyl-N-piperidin-4-yl-N-propylpyridine-3-carboxamide
PubChem CID119824704
Molecular FormulaC20H25N3O
Molecular Weight323.44 g/mol
Exact Mass323.20
IUPAC Name5-phenyl-N-piperidin-4-yl-N-propylpyridine-3-carboxamide
SMILESCCCN(C(=O)c1cncc(-c2ccccc2)c1)C1CCNCC1
InChIInChI=1S/C20H25N3O/c1-2-12-23(19-8-10-21-11-9-19)20(24)18-13-17(14-22-15-18)16-6-4-3-5-7-16/h3-7,13-15,19,21H,2,8-12H2,1H3
InChIKeyOTJQRYIMRXNKKM-UHFFFAOYSA-N
XLogP3.35
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.44
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-5-phenyl-N-pyrrolidin-3-ylpyridine-3-carboxamide
CID 119552362
N-methyl-5-phenyl-N-pyrrolidin-3-ylpyridine-3-carboxamide;dihydrochloride
CID 119552361
N-piperidin-4-yl-N-propylpyridine-4-carboxamide
CID 54923494
3-[piperidin-4-yl(propyl)carbamoyl]benzoic acid
CID 61408528
2-phenyl-N-piperidin-4-yl-N-propylquinoline-4-carboxamide
CID 119826187
3-phenyl-N-piperidin-4-yl-N-propyl-1,2-oxazole-5-carboxamide
CID 119825777
N-piperidin-4-yl-N-propylnaphthalene-1-carboxamide
CID 119824426
1-benzyl-N-piperidin-4-yl-N-propylpyrazole-4-carboxamide;hydrochloride
CID 91645692
2-chloro-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
CID 119826015
2-phenyl-N-piperidin-4-yl-N-propyltriazole-4-carboxamide
CID 119825765
3,5-dimethyl-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
CID 119824323
4-(phenylcarbamoylamino)-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
CID 119824537

Frequently Asked Questions

What is the IUPAC name of 5-phenyl-N-piperidin-4-yl-N-propylpyridine-3-carboxamide?
The IUPAC name of 5-phenyl-N-piperidin-4-yl-N-propylpyridine-3-carboxamide (CID 119824704) is 5-phenyl-N-piperidin-4-yl-N-propylpyridine-3-carboxamide.
What is the SMILES notation for 5-phenyl-N-piperidin-4-yl-N-propylpyridine-3-carboxamide?
The canonical SMILES for 5-phenyl-N-piperidin-4-yl-N-propylpyridine-3-carboxamide is CCCN(C(=O)c1cncc(-c2ccccc2)c1)C1CCNCC1.
What is the InChIKey of 5-phenyl-N-piperidin-4-yl-N-propylpyridine-3-carboxamide?
The InChIKey is OTJQRYIMRXNKKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O/c1-2-12-23(19-8-10-21-11-9-19)20(24)18-13-17(14-22-15-18)16-6-4-3-5-7-16/h3-7,13-15,19,21H,2,8-12H2,1H3.
What are the key properties of 5-phenyl-N-piperidin-4-yl-N-propylpyridine-3-carboxamide?
5-phenyl-N-piperidin-4-yl-N-propylpyridine-3-carboxamide has a molecular weight of 323.44 g/mol, XLogP of 3.35, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-N-piperidin-4-yl-N-propylpyridine-3-carboxamide is sourced from PubChem (CID 119824704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).