5-(3-methylpiperidin-1-yl)-N-propylpyridine-3-carboxamide

C15H23N3O — CID 109222844

IUPAC5-(3-methylpiperidin-1-yl)-N-propylpyridine-3-carboxamide
SMILESCCCNC(=O)c1cncc(N2CCCC(C)C2)c1
InChIInChI=1S/C15H23N3O/c1-3-6-17-15(19)13-8-14(10-16-9-13)18-7-4-5-12(2)11-18/h8-10,12H,3-7,11H2,1-2H3,(H,17,19)
InChIKeyJPNMOINEPCPZNJ-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.46
Rot. Bonds4

About 5-(3-methylpiperidin-1-yl)-N-propylpyridine-3-carboxamide

5-(3-methylpiperidin-1-yl)-N-propylpyridine-3-carboxamide (PubChem CID 109222844) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 5-(3-methylpiperidin-1-yl)-N-propylpyridine-3-carboxamide.

Molecular Properties

Compound Name5-(3-methylpiperidin-1-yl)-N-propylpyridine-3-carboxamide
PubChem CID109222844
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name5-(3-methylpiperidin-1-yl)-N-propylpyridine-3-carboxamide
SMILESCCCNC(=O)c1cncc(N2CCCC(C)C2)c1
InChIInChI=1S/C15H23N3O/c1-3-6-17-15(19)13-8-14(10-16-9-13)18-7-4-5-12(2)11-18/h8-10,12H,3-7,11H2,1-2H3,(H,17,19)
InChIKeyJPNMOINEPCPZNJ-UHFFFAOYSA-N
XLogP2.46
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(3-methylpiperidin-1-yl)-N-propylpyridine-3-carboxamide?
The IUPAC name of 5-(3-methylpiperidin-1-yl)-N-propylpyridine-3-carboxamide (CID 109222844) is 5-(3-methylpiperidin-1-yl)-N-propylpyridine-3-carboxamide.
What is the SMILES notation for 5-(3-methylpiperidin-1-yl)-N-propylpyridine-3-carboxamide?
The canonical SMILES for 5-(3-methylpiperidin-1-yl)-N-propylpyridine-3-carboxamide is CCCNC(=O)c1cncc(N2CCCC(C)C2)c1.
What is the InChIKey of 5-(3-methylpiperidin-1-yl)-N-propylpyridine-3-carboxamide?
The InChIKey is JPNMOINEPCPZNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-3-6-17-15(19)13-8-14(10-16-9-13)18-7-4-5-12(2)11-18/h8-10,12H,3-7,11H2,1-2H3,(H,17,19).
What are the key properties of 5-(3-methylpiperidin-1-yl)-N-propylpyridine-3-carboxamide?
5-(3-methylpiperidin-1-yl)-N-propylpyridine-3-carboxamide has a molecular weight of 261.37 g/mol, XLogP of 2.46, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-methylpiperidin-1-yl)-N-propylpyridine-3-carboxamide is sourced from PubChem (CID 109222844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).