N-(piperidin-2-ylmethyl)-N-propylpyridine-4-carboxamide

C15H23N3O — CID 106625818

IUPACN-(piperidin-2-ylmethyl)-N-propylpyridine-4-carboxamide
SMILESCCCN(CC1CCCCN1)C(=O)c1ccncc1
InChIInChI=1S/C15H23N3O/c1-2-11-18(12-14-5-3-4-8-17-14)15(19)13-6-9-16-10-7-13/h6-7,9-10,14,17H,2-5,8,11-12H2,1H3
InChIKeyHLWDMPNCOLAVKH-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.08
Rot. Bonds5

About N-(piperidin-2-ylmethyl)-N-propylpyridine-4-carboxamide

N-(piperidin-2-ylmethyl)-N-propylpyridine-4-carboxamide (PubChem CID 106625818) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-(piperidin-2-ylmethyl)-N-propylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-(piperidin-2-ylmethyl)-N-propylpyridine-4-carboxamide
PubChem CID106625818
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-(piperidin-2-ylmethyl)-N-propylpyridine-4-carboxamide
SMILESCCCN(CC1CCCCN1)C(=O)c1ccncc1
InChIInChI=1S/C15H23N3O/c1-2-11-18(12-14-5-3-4-8-17-14)15(19)13-6-9-16-10-7-13/h6-7,9-10,14,17H,2-5,8,11-12H2,1H3
InChIKeyHLWDMPNCOLAVKH-UHFFFAOYSA-N
XLogP2.08
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(piperidin-2-ylmethyl)-N-propylpyrimidine-5-carboxamide
CID 106625552
3,4-dichloro-N-(piperidin-2-ylmethyl)-N-propylbenzamide
CID 106625495
2-methyl-N-propyl-N-(pyrrolidin-2-ylmethyl)pyridine-4-carboxamide
CID 106753772
2-methyl-N-(piperidin-2-ylmethyl)-N-propylpyrazole-3-carboxamide
CID 106625760
N-(piperidin-2-ylmethyl)-N-propylthiophene-2-carboxamide
CID 106625496
5-methyl-N-(piperidin-2-ylmethyl)-N-propylfuran-3-carboxamide
CID 106625551
4-fluoro-3-methyl-N-(piperidin-2-ylmethyl)-N-propylbenzamide
CID 106625701
5-iodo-N-(piperidin-2-ylmethyl)-N-propylthiophene-3-carboxamide
CID 106625541
3,4-difluoro-N-propyl-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106610422
3-methyl-N-propyl-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106610518
N-propyl-N-(pyrrolidin-2-ylmethyl)pyridine-2-carboxamide
CID 106610741
5-chloro-N-(piperidin-2-ylmethyl)-N-propylthiophene-2-carboxamide
CID 106625640

Frequently Asked Questions

What is the IUPAC name of N-(piperidin-2-ylmethyl)-N-propylpyridine-4-carboxamide?
The IUPAC name of N-(piperidin-2-ylmethyl)-N-propylpyridine-4-carboxamide (CID 106625818) is N-(piperidin-2-ylmethyl)-N-propylpyridine-4-carboxamide.
What is the SMILES notation for N-(piperidin-2-ylmethyl)-N-propylpyridine-4-carboxamide?
The canonical SMILES for N-(piperidin-2-ylmethyl)-N-propylpyridine-4-carboxamide is CCCN(CC1CCCCN1)C(=O)c1ccncc1.
What is the InChIKey of N-(piperidin-2-ylmethyl)-N-propylpyridine-4-carboxamide?
The InChIKey is HLWDMPNCOLAVKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-2-11-18(12-14-5-3-4-8-17-14)15(19)13-6-9-16-10-7-13/h6-7,9-10,14,17H,2-5,8,11-12H2,1H3.
What are the key properties of N-(piperidin-2-ylmethyl)-N-propylpyridine-4-carboxamide?
N-(piperidin-2-ylmethyl)-N-propylpyridine-4-carboxamide has a molecular weight of 261.37 g/mol, XLogP of 2.08, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(piperidin-2-ylmethyl)-N-propylpyridine-4-carboxamide is sourced from PubChem (CID 106625818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).