N,N-dimethyl-1-(4-pyrazol-1-yl-3-pyridinyl)piperidine-4-carboxamide

C16H21N5O — CID 118450716

IUPACN,N-dimethyl-1-(4-pyrazol-1-yl-3-pyridinyl)piperidine-4-carboxamide
SMILESCN(C)C(=O)C1CCN(c2cnccc2-n2cccn2)CC1
InChIInChI=1S/C16H21N5O/c1-19(2)16(22)13-5-10-20(11-6-13)15-12-17-8-4-14(15)21-9-3-7-18-21/h3-4,7-9,12-13H,5-6,10-11H2,1-2H3
InChIKeySXWXWNVGLHVWJF-UHFFFAOYSA-N
MW299.38 g/mol
LogP1.57
Rot. Bonds3

About N,N-dimethyl-1-(4-pyrazol-1-yl-3-pyridinyl)piperidine-4-carboxamide

N,N-dimethyl-1-(4-pyrazol-1-yl-3-pyridinyl)piperidine-4-carboxamide (PubChem CID 118450716) has the molecular formula C16H21N5O and a molecular weight of 299.38 g/mol. Its IUPAC name is N,N-dimethyl-1-(4-pyrazol-1-yl-3-pyridinyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-1-(4-pyrazol-1-yl-3-pyridinyl)piperidine-4-carboxamide
PubChem CID118450716
Molecular FormulaC16H21N5O
Molecular Weight299.38 g/mol
Exact Mass299.17
IUPAC NameN,N-dimethyl-1-(4-pyrazol-1-yl-3-pyridinyl)piperidine-4-carboxamide
SMILESCN(C)C(=O)C1CCN(c2cnccc2-n2cccn2)CC1
InChIInChI=1S/C16H21N5O/c1-19(2)16(22)13-5-10-20(11-6-13)15-12-17-8-4-14(15)21-9-3-7-18-21/h3-4,7-9,12-13H,5-6,10-11H2,1-2H3
InChIKeySXWXWNVGLHVWJF-UHFFFAOYSA-N
XLogP1.57
TPSA54.26 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.38
LogP ≤ 51.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-(4-pyrazol-1-yl-3-pyridinyl)piperidine-4-carboxamide?
The IUPAC name of N,N-dimethyl-1-(4-pyrazol-1-yl-3-pyridinyl)piperidine-4-carboxamide (CID 118450716) is N,N-dimethyl-1-(4-pyrazol-1-yl-3-pyridinyl)piperidine-4-carboxamide.
What is the SMILES notation for N,N-dimethyl-1-(4-pyrazol-1-yl-3-pyridinyl)piperidine-4-carboxamide?
The canonical SMILES for N,N-dimethyl-1-(4-pyrazol-1-yl-3-pyridinyl)piperidine-4-carboxamide is CN(C)C(=O)C1CCN(c2cnccc2-n2cccn2)CC1.
What is the InChIKey of N,N-dimethyl-1-(4-pyrazol-1-yl-3-pyridinyl)piperidine-4-carboxamide?
The InChIKey is SXWXWNVGLHVWJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N5O/c1-19(2)16(22)13-5-10-20(11-6-13)15-12-17-8-4-14(15)21-9-3-7-18-21/h3-4,7-9,12-13H,5-6,10-11H2,1-2H3.
What are the key properties of N,N-dimethyl-1-(4-pyrazol-1-yl-3-pyridinyl)piperidine-4-carboxamide?
N,N-dimethyl-1-(4-pyrazol-1-yl-3-pyridinyl)piperidine-4-carboxamide has a molecular weight of 299.38 g/mol, XLogP of 1.57, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-(4-pyrazol-1-yl-3-pyridinyl)piperidine-4-carboxamide is sourced from PubChem (CID 118450716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).