N,1,3-trimethyl-N-(2-pyridin-4-ylethyl)pyrazole-4-carboxamide

C14H18N4O — CID 110852590

IUPACN,1,3-trimethyl-N-(2-pyridin-4-ylethyl)pyrazole-4-carboxamide
SMILESCc1nn(C)cc1C(=O)N(C)CCc1ccncc1
InChIInChI=1S/C14H18N4O/c1-11-13(10-18(3)16-11)14(19)17(2)9-6-12-4-7-15-8-5-12/h4-5,7-8,10H,6,9H2,1-3H3
InChIKeyZOYFNAYLCJGIFJ-UHFFFAOYSA-N
MW258.32 g/mol
LogP1.44
Rot. Bonds4

About N,1,3-trimethyl-N-(2-pyridin-4-ylethyl)pyrazole-4-carboxamide

N,1,3-trimethyl-N-(2-pyridin-4-ylethyl)pyrazole-4-carboxamide (PubChem CID 110852590) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is N,1,3-trimethyl-N-(2-pyridin-4-ylethyl)pyrazole-4-carboxamide.

Molecular Properties

Compound NameN,1,3-trimethyl-N-(2-pyridin-4-ylethyl)pyrazole-4-carboxamide
PubChem CID110852590
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC NameN,1,3-trimethyl-N-(2-pyridin-4-ylethyl)pyrazole-4-carboxamide
SMILESCc1nn(C)cc1C(=O)N(C)CCc1ccncc1
InChIInChI=1S/C14H18N4O/c1-11-13(10-18(3)16-11)14(19)17(2)9-6-12-4-7-15-8-5-12/h4-5,7-8,10H,6,9H2,1-3H3
InChIKeyZOYFNAYLCJGIFJ-UHFFFAOYSA-N
XLogP1.44
TPSA51.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 51.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N,1,3-trimethyl-N-(2-pyridin-4-ylethyl)pyrazole-5-carboxamide
CID 66123007
N,2,4-trimethyl-N-(2-pyridin-4-ylethyl)pyrimidine-5-carboxamide
CID 110852637
4-chloro-N-methyl-N-(2-pyridin-4-ylethyl)pyridine-3-carboxamide
CID 81226415
N-methyl-4-oxo-N-(2-pyridin-4-ylethyl)-1H-pyridine-3-carboxamide
CID 103337389
N-(2-hydroxypropyl)-N,1,3-trimethylpyrazole-4-carboxamide
CID 103747215
4-methoxy-N,2,5-trimethyl-N-(2-pyridin-4-ylethyl)benzamide
CID 110761596
1-cyclopropyl-N,2,5-trimethyl-N-(2-pyridin-4-ylethyl)pyrrole-3-carboxamide
CID 110698865
N-methyl-N-(2-pyridin-4-ylethyl)-1,3-thiazole-5-carboxamide
CID 110852596
N,3-dimethyl-N-(2-pyridin-4-ylethyl)furan-2-carboxamide
CID 110695643
N-methyl-N-(2-pyridin-4-ylethyl)pyrimidine-4-carboxamide
CID 110699109
1-N-butyl-1-N,4-N-dimethyl-4-N-(2-pyridin-4-ylethyl)benzene-1,4-dicarboxamide
CID 109048088
N-methyl-N-(2-pyridin-4-ylethyl)-1,3-oxazole-4-carboxamide
CID 110689492

Frequently Asked Questions

What is the IUPAC name of N,1,3-trimethyl-N-(2-pyridin-4-ylethyl)pyrazole-4-carboxamide?
The IUPAC name of N,1,3-trimethyl-N-(2-pyridin-4-ylethyl)pyrazole-4-carboxamide (CID 110852590) is N,1,3-trimethyl-N-(2-pyridin-4-ylethyl)pyrazole-4-carboxamide.
What is the SMILES notation for N,1,3-trimethyl-N-(2-pyridin-4-ylethyl)pyrazole-4-carboxamide?
The canonical SMILES for N,1,3-trimethyl-N-(2-pyridin-4-ylethyl)pyrazole-4-carboxamide is Cc1nn(C)cc1C(=O)N(C)CCc1ccncc1.
What is the InChIKey of N,1,3-trimethyl-N-(2-pyridin-4-ylethyl)pyrazole-4-carboxamide?
The InChIKey is ZOYFNAYLCJGIFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-11-13(10-18(3)16-11)14(19)17(2)9-6-12-4-7-15-8-5-12/h4-5,7-8,10H,6,9H2,1-3H3.
What are the key properties of N,1,3-trimethyl-N-(2-pyridin-4-ylethyl)pyrazole-4-carboxamide?
N,1,3-trimethyl-N-(2-pyridin-4-ylethyl)pyrazole-4-carboxamide has a molecular weight of 258.32 g/mol, XLogP of 1.44, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,1,3-trimethyl-N-(2-pyridin-4-ylethyl)pyrazole-4-carboxamide is sourced from PubChem (CID 110852590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).