N-ethyl-5-methyl-N-(piperidin-3-ylmethyl)pyridine-3-carboxamide

C15H23N3O — CID 106629522

IUPACN-ethyl-5-methyl-N-(piperidin-3-ylmethyl)pyridine-3-carboxamide
SMILESCCN(CC1CCCNC1)C(=O)c1cncc(C)c1
InChIInChI=1S/C15H23N3O/c1-3-18(11-13-5-4-6-16-9-13)15(19)14-7-12(2)8-17-10-14/h7-8,10,13,16H,3-6,9,11H2,1-2H3
InChIKeyRVZSHAUMCFSEIB-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.85
Rot. Bonds4

About N-ethyl-5-methyl-N-(piperidin-3-ylmethyl)pyridine-3-carboxamide

N-ethyl-5-methyl-N-(piperidin-3-ylmethyl)pyridine-3-carboxamide (PubChem CID 106629522) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-ethyl-5-methyl-N-(piperidin-3-ylmethyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-5-methyl-N-(piperidin-3-ylmethyl)pyridine-3-carboxamide
PubChem CID106629522
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-ethyl-5-methyl-N-(piperidin-3-ylmethyl)pyridine-3-carboxamide
SMILESCCN(CC1CCCNC1)C(=O)c1cncc(C)c1
InChIInChI=1S/C15H23N3O/c1-3-18(11-13-5-4-6-16-9-13)15(19)14-7-12(2)8-17-10-14/h7-8,10,13,16H,3-6,9,11H2,1-2H3
InChIKeyRVZSHAUMCFSEIB-UHFFFAOYSA-N
XLogP1.85
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 ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-methyl-N-(piperidin-3-ylmethyl)pyridine-3-carboxamide?
The IUPAC name of N-ethyl-5-methyl-N-(piperidin-3-ylmethyl)pyridine-3-carboxamide (CID 106629522) is N-ethyl-5-methyl-N-(piperidin-3-ylmethyl)pyridine-3-carboxamide.
What is the SMILES notation for N-ethyl-5-methyl-N-(piperidin-3-ylmethyl)pyridine-3-carboxamide?
The canonical SMILES for N-ethyl-5-methyl-N-(piperidin-3-ylmethyl)pyridine-3-carboxamide is CCN(CC1CCCNC1)C(=O)c1cncc(C)c1.
What is the InChIKey of N-ethyl-5-methyl-N-(piperidin-3-ylmethyl)pyridine-3-carboxamide?
The InChIKey is RVZSHAUMCFSEIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-3-18(11-13-5-4-6-16-9-13)15(19)14-7-12(2)8-17-10-14/h7-8,10,13,16H,3-6,9,11H2,1-2H3.
What are the key properties of N-ethyl-5-methyl-N-(piperidin-3-ylmethyl)pyridine-3-carboxamide?
N-ethyl-5-methyl-N-(piperidin-3-ylmethyl)pyridine-3-carboxamide has a molecular weight of 261.37 g/mol, XLogP of 1.85, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-methyl-N-(piperidin-3-ylmethyl)pyridine-3-carboxamide is sourced from PubChem (CID 106629522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).