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

C15H23N3O — CID 107067802

IUPACN,3-dimethyl-N-(1-pyridin-4-ylethyl)piperidine-2-carboxamide
SMILESCC1CCCNC1C(=O)N(C)C(C)c1ccncc1
InChIInChI=1S/C15H23N3O/c1-11-5-4-8-17-14(11)15(19)18(3)12(2)13-6-9-16-10-7-13/h6-7,9-12,14,17H,4-5,8H2,1-3H3
InChIKeyZIROVVIJGWUMMB-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.99
Rot. Bonds3

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

N,3-dimethyl-N-(1-pyridin-4-ylethyl)piperidine-2-carboxamide (PubChem CID 107067802) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N,3-dimethyl-N-(1-pyridin-4-ylethyl)piperidine-2-carboxamide.

Molecular Properties

Compound NameN,3-dimethyl-N-(1-pyridin-4-ylethyl)piperidine-2-carboxamide
PubChem CID107067802
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN,3-dimethyl-N-(1-pyridin-4-ylethyl)piperidine-2-carboxamide
SMILESCC1CCCNC1C(=O)N(C)C(C)c1ccncc1
InChIInChI=1S/C15H23N3O/c1-11-5-4-8-17-14(11)15(19)18(3)12(2)13-6-9-16-10-7-13/h6-7,9-12,14,17H,4-5,8H2,1-3H3
InChIKeyZIROVVIJGWUMMB-UHFFFAOYSA-N
XLogP1.99
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,3-dimethyl-N-(1-pyridin-4-ylethyl)piperidine-2-carboxamide?
The IUPAC name of N,3-dimethyl-N-(1-pyridin-4-ylethyl)piperidine-2-carboxamide (CID 107067802) is N,3-dimethyl-N-(1-pyridin-4-ylethyl)piperidine-2-carboxamide.
What is the SMILES notation for N,3-dimethyl-N-(1-pyridin-4-ylethyl)piperidine-2-carboxamide?
The canonical SMILES for N,3-dimethyl-N-(1-pyridin-4-ylethyl)piperidine-2-carboxamide is CC1CCCNC1C(=O)N(C)C(C)c1ccncc1.
What is the InChIKey of N,3-dimethyl-N-(1-pyridin-4-ylethyl)piperidine-2-carboxamide?
The InChIKey is ZIROVVIJGWUMMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-11-5-4-8-17-14(11)15(19)18(3)12(2)13-6-9-16-10-7-13/h6-7,9-12,14,17H,4-5,8H2,1-3H3.
What are the key properties of N,3-dimethyl-N-(1-pyridin-4-ylethyl)piperidine-2-carboxamide?
N,3-dimethyl-N-(1-pyridin-4-ylethyl)piperidine-2-carboxamide has a molecular weight of 261.37 g/mol, XLogP of 1.99, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethyl-N-(1-pyridin-4-ylethyl)piperidine-2-carboxamide is sourced from PubChem (CID 107067802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).