N,N-diethyl-3-[(6-methyl-2-pyridinyl)sulfonyl]pyrazole-1-carboxamide

C14H18N4O3S — CID 19931910

IUPACN,N-diethyl-3-[(6-methyl-2-pyridinyl)sulfonyl]pyrazole-1-carboxamide
SMILESCCN(CC)C(=O)n1ccc(S(=O)(=O)c2cccc(C)n2)n1
InChIInChI=1S/C14H18N4O3S/c1-4-17(5-2)14(19)18-10-9-13(16-18)22(20,21)12-8-6-7-11(3)15-12/h6-10H,4-5H2,1-3H3
InChIKeyYDMUGFPFICNXHX-UHFFFAOYSA-N
MW322.39 g/mol
LogP1.73
Rot. Bonds4

About N,N-diethyl-3-[(6-methyl-2-pyridinyl)sulfonyl]pyrazole-1-carboxamide

N,N-diethyl-3-[(6-methyl-2-pyridinyl)sulfonyl]pyrazole-1-carboxamide (PubChem CID 19931910) has the molecular formula C14H18N4O3S and a molecular weight of 322.39 g/mol. Its IUPAC name is N,N-diethyl-3-[(6-methyl-2-pyridinyl)sulfonyl]pyrazole-1-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-3-[(6-methyl-2-pyridinyl)sulfonyl]pyrazole-1-carboxamide
PubChem CID19931910
Molecular FormulaC14H18N4O3S
Molecular Weight322.39 g/mol
Exact Mass322.11
IUPAC NameN,N-diethyl-3-[(6-methyl-2-pyridinyl)sulfonyl]pyrazole-1-carboxamide
SMILESCCN(CC)C(=O)n1ccc(S(=O)(=O)c2cccc(C)n2)n1
InChIInChI=1S/C14H18N4O3S/c1-4-17(5-2)14(19)18-10-9-13(16-18)22(20,21)12-8-6-7-11(3)15-12/h6-10H,4-5H2,1-3H3
InChIKeyYDMUGFPFICNXHX-UHFFFAOYSA-N
XLogP1.73
TPSA85.16 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.39
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze N,N-diethyl-3-[(6-methyl-2-pyridinyl)sulfonyl]pyrazole-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-3-[(6-methyl-2-pyridinyl)sulfonyl]pyrazole-1-carboxamide?
The IUPAC name of N,N-diethyl-3-[(6-methyl-2-pyridinyl)sulfonyl]pyrazole-1-carboxamide (CID 19931910) is N,N-diethyl-3-[(6-methyl-2-pyridinyl)sulfonyl]pyrazole-1-carboxamide.
What is the SMILES notation for N,N-diethyl-3-[(6-methyl-2-pyridinyl)sulfonyl]pyrazole-1-carboxamide?
The canonical SMILES for N,N-diethyl-3-[(6-methyl-2-pyridinyl)sulfonyl]pyrazole-1-carboxamide is CCN(CC)C(=O)n1ccc(S(=O)(=O)c2cccc(C)n2)n1.
What is the InChIKey of N,N-diethyl-3-[(6-methyl-2-pyridinyl)sulfonyl]pyrazole-1-carboxamide?
The InChIKey is YDMUGFPFICNXHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O3S/c1-4-17(5-2)14(19)18-10-9-13(16-18)22(20,21)12-8-6-7-11(3)15-12/h6-10H,4-5H2,1-3H3.
What are the key properties of N,N-diethyl-3-[(6-methyl-2-pyridinyl)sulfonyl]pyrazole-1-carboxamide?
N,N-diethyl-3-[(6-methyl-2-pyridinyl)sulfonyl]pyrazole-1-carboxamide has a molecular weight of 322.39 g/mol, XLogP of 1.73, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-3-[(6-methyl-2-pyridinyl)sulfonyl]pyrazole-1-carboxamide is sourced from PubChem (CID 19931910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).