5-methyl-N-(piperidin-4-ylmethyl)-N-propylpyridine-3-carboxamide

C16H25N3O — CID 79720330

IUPAC5-methyl-N-(piperidin-4-ylmethyl)-N-propylpyridine-3-carboxamide
SMILESCCCN(CC1CCNCC1)C(=O)c1cncc(C)c1
InChIInChI=1S/C16H25N3O/c1-3-8-19(12-14-4-6-17-7-5-14)16(20)15-9-13(2)10-18-11-15/h9-11,14,17H,3-8,12H2,1-2H3
InChIKeyMJPRKQKAWFKZFT-UHFFFAOYSA-N
MW275.40 g/mol
LogP2.24
Rot. Bonds5

About 5-methyl-N-(piperidin-4-ylmethyl)-N-propylpyridine-3-carboxamide

5-methyl-N-(piperidin-4-ylmethyl)-N-propylpyridine-3-carboxamide (PubChem CID 79720330) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is 5-methyl-N-(piperidin-4-ylmethyl)-N-propylpyridine-3-carboxamide.

Molecular Properties

Compound Name5-methyl-N-(piperidin-4-ylmethyl)-N-propylpyridine-3-carboxamide
PubChem CID79720330
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC Name5-methyl-N-(piperidin-4-ylmethyl)-N-propylpyridine-3-carboxamide
SMILESCCCN(CC1CCNCC1)C(=O)c1cncc(C)c1
InChIInChI=1S/C16H25N3O/c1-3-8-19(12-14-4-6-17-7-5-14)16(20)15-9-13(2)10-18-11-15/h9-11,14,17H,3-8,12H2,1-2H3
InChIKeyMJPRKQKAWFKZFT-UHFFFAOYSA-N
XLogP2.24
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-bromo-5-methyl-N-(piperidin-4-ylmethyl)-N-propylbenzamide
CID 115999695
N-ethyl-5-methyl-N-(piperidin-3-ylmethyl)pyridine-3-carboxamide
CID 106629522
4-iodo-N-(piperidin-4-ylmethyl)-N-propylbenzamide
CID 79721151
1,5-dimethyl-N-(piperidin-4-ylmethyl)-N-propylpyrazole-4-carboxamide
CID 79720334
4-methoxy-N-(piperidin-4-ylmethyl)-N-propylbenzamide
CID 79702846
N-ethyl-5-methyl-N-(piperidin-2-ylmethyl)pyridine-3-carboxamide
CID 106626172
5-nitro-N-(piperidin-4-ylmethyl)-N-propylthiophene-3-carboxamide
CID 79701574
4,5-dichloro-N-(piperidin-4-ylmethyl)-N-propyl-1H-pyrrole-2-carboxamide
CID 79720994
5-fluoro-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyridine-3-carboxamide
CID 104786254
3-methyl-N-(piperidin-4-ylmethyl)-N-propylfuran-2-carboxamide
CID 79720557
2,4-dichloro-N-(piperidin-4-ylmethyl)-N-propylbenzamide
CID 79700911
2,6-dichloro-N-(piperidin-4-ylmethyl)-N-propylbenzamide
CID 79702520

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(piperidin-4-ylmethyl)-N-propylpyridine-3-carboxamide?
The IUPAC name of 5-methyl-N-(piperidin-4-ylmethyl)-N-propylpyridine-3-carboxamide (CID 79720330) is 5-methyl-N-(piperidin-4-ylmethyl)-N-propylpyridine-3-carboxamide.
What is the SMILES notation for 5-methyl-N-(piperidin-4-ylmethyl)-N-propylpyridine-3-carboxamide?
The canonical SMILES for 5-methyl-N-(piperidin-4-ylmethyl)-N-propylpyridine-3-carboxamide is CCCN(CC1CCNCC1)C(=O)c1cncc(C)c1.
What is the InChIKey of 5-methyl-N-(piperidin-4-ylmethyl)-N-propylpyridine-3-carboxamide?
The InChIKey is MJPRKQKAWFKZFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-3-8-19(12-14-4-6-17-7-5-14)16(20)15-9-13(2)10-18-11-15/h9-11,14,17H,3-8,12H2,1-2H3.
What are the key properties of 5-methyl-N-(piperidin-4-ylmethyl)-N-propylpyridine-3-carboxamide?
5-methyl-N-(piperidin-4-ylmethyl)-N-propylpyridine-3-carboxamide has a molecular weight of 275.40 g/mol, XLogP of 2.24, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(piperidin-4-ylmethyl)-N-propylpyridine-3-carboxamide is sourced from PubChem (CID 79720330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).