N,1-dimethyl-N-(2-pyridin-4-ylethyl)piperidine-3-carboxamide

C15H23N3O — CID 110852658

IUPACN,1-dimethyl-N-(2-pyridin-4-ylethyl)piperidine-3-carboxamide
SMILESCN1CCCC(C(=O)N(C)CCc2ccncc2)C1
InChIInChI=1S/C15H23N3O/c1-17-10-3-4-14(12-17)15(19)18(2)11-7-13-5-8-16-9-6-13/h5-6,8-9,14H,3-4,7,10-12H2,1-2H3
InChIKeyCHMLPTUEWMYGFW-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.42
Rot. Bonds4

About N,1-dimethyl-N-(2-pyridin-4-ylethyl)piperidine-3-carboxamide

N,1-dimethyl-N-(2-pyridin-4-ylethyl)piperidine-3-carboxamide (PubChem CID 110852658) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N,1-dimethyl-N-(2-pyridin-4-ylethyl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN,1-dimethyl-N-(2-pyridin-4-ylethyl)piperidine-3-carboxamide
PubChem CID110852658
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN,1-dimethyl-N-(2-pyridin-4-ylethyl)piperidine-3-carboxamide
SMILESCN1CCCC(C(=O)N(C)CCc2ccncc2)C1
InChIInChI=1S/C15H23N3O/c1-17-10-3-4-14(12-17)15(19)18(2)11-7-13-5-8-16-9-6-13/h5-6,8-9,14H,3-4,7,10-12H2,1-2H3
InChIKeyCHMLPTUEWMYGFW-UHFFFAOYSA-N
XLogP1.42
TPSA36.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,1-dimethyl-N-(2-pyridin-4-ylethyl)piperidine-3-carboxamide?
The IUPAC name of N,1-dimethyl-N-(2-pyridin-4-ylethyl)piperidine-3-carboxamide (CID 110852658) is N,1-dimethyl-N-(2-pyridin-4-ylethyl)piperidine-3-carboxamide.
What is the SMILES notation for N,1-dimethyl-N-(2-pyridin-4-ylethyl)piperidine-3-carboxamide?
The canonical SMILES for N,1-dimethyl-N-(2-pyridin-4-ylethyl)piperidine-3-carboxamide is CN1CCCC(C(=O)N(C)CCc2ccncc2)C1.
What is the InChIKey of N,1-dimethyl-N-(2-pyridin-4-ylethyl)piperidine-3-carboxamide?
The InChIKey is CHMLPTUEWMYGFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-17-10-3-4-14(12-17)15(19)18(2)11-7-13-5-8-16-9-6-13/h5-6,8-9,14H,3-4,7,10-12H2,1-2H3.
What are the key properties of N,1-dimethyl-N-(2-pyridin-4-ylethyl)piperidine-3-carboxamide?
N,1-dimethyl-N-(2-pyridin-4-ylethyl)piperidine-3-carboxamide has a molecular weight of 261.37 g/mol, XLogP of 1.42, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dimethyl-N-(2-pyridin-4-ylethyl)piperidine-3-carboxamide is sourced from PubChem (CID 110852658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).