N-cyclopropyl-5-methyl-N-(piperidin-2-ylmethyl)pyridine-3-carboxamide

C16H23N3O — CID 106626967

IUPACN-cyclopropyl-5-methyl-N-(piperidin-2-ylmethyl)pyridine-3-carboxamide
SMILESCc1cncc(C(=O)N(CC2CCCCN2)C2CC2)c1
InChIInChI=1S/C16H23N3O/c1-12-8-13(10-17-9-12)16(20)19(15-5-6-15)11-14-4-2-3-7-18-14/h8-10,14-15,18H,2-7,11H2,1H3
InChIKeySWEIEZBZRVPPCZ-UHFFFAOYSA-N
MW273.38 g/mol
LogP2.14
Rot. Bonds4

About N-cyclopropyl-5-methyl-N-(piperidin-2-ylmethyl)pyridine-3-carboxamide

N-cyclopropyl-5-methyl-N-(piperidin-2-ylmethyl)pyridine-3-carboxamide (PubChem CID 106626967) has the molecular formula C16H23N3O and a molecular weight of 273.38 g/mol. Its IUPAC name is N-cyclopropyl-5-methyl-N-(piperidin-2-ylmethyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-5-methyl-N-(piperidin-2-ylmethyl)pyridine-3-carboxamide
PubChem CID106626967
Molecular FormulaC16H23N3O
Molecular Weight273.38 g/mol
Exact Mass273.18
IUPAC NameN-cyclopropyl-5-methyl-N-(piperidin-2-ylmethyl)pyridine-3-carboxamide
SMILESCc1cncc(C(=O)N(CC2CCCCN2)C2CC2)c1
InChIInChI=1S/C16H23N3O/c1-12-8-13(10-17-9-12)16(20)19(15-5-6-15)11-14-4-2-3-7-18-14/h8-10,14-15,18H,2-7,11H2,1H3
InChIKeySWEIEZBZRVPPCZ-UHFFFAOYSA-N
XLogP2.14
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-5-methyl-N-(piperidin-2-ylmethyl)pyridine-3-carboxamide?
The IUPAC name of N-cyclopropyl-5-methyl-N-(piperidin-2-ylmethyl)pyridine-3-carboxamide (CID 106626967) is N-cyclopropyl-5-methyl-N-(piperidin-2-ylmethyl)pyridine-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-5-methyl-N-(piperidin-2-ylmethyl)pyridine-3-carboxamide?
The canonical SMILES for N-cyclopropyl-5-methyl-N-(piperidin-2-ylmethyl)pyridine-3-carboxamide is Cc1cncc(C(=O)N(CC2CCCCN2)C2CC2)c1.
What is the InChIKey of N-cyclopropyl-5-methyl-N-(piperidin-2-ylmethyl)pyridine-3-carboxamide?
The InChIKey is SWEIEZBZRVPPCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O/c1-12-8-13(10-17-9-12)16(20)19(15-5-6-15)11-14-4-2-3-7-18-14/h8-10,14-15,18H,2-7,11H2,1H3.
What are the key properties of N-cyclopropyl-5-methyl-N-(piperidin-2-ylmethyl)pyridine-3-carboxamide?
N-cyclopropyl-5-methyl-N-(piperidin-2-ylmethyl)pyridine-3-carboxamide has a molecular weight of 273.38 g/mol, XLogP of 2.14, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-5-methyl-N-(piperidin-2-ylmethyl)pyridine-3-carboxamide is sourced from PubChem (CID 106626967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).