3-(3-chlorophenyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1H-pyrazole-5-carboxamide;hydrochloride

C19H26Cl2N4O — CID 155970156

IUPAC3-(3-chlorophenyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1H-pyrazole-5-carboxamide;hydrochloride
SMILESCC1(C)CC(NC(=O)c2cc(-c3cccc(Cl)c3)n[nH]2)CC(C)(C)N1.Cl
InChIInChI=1S/C19H25ClN4O.ClH/c1-18(2)10-14(11-19(3,4)24-18)21-17(25)16-9-15(22-23-16)12-6-5-7-13(20)8-12;/h5-9,14,24H,10-11H2,1-4H3,(H,21,25)(H,22,23);1H
InChIKeyXEGPSMIBVRFJTB-UHFFFAOYSA-N
MW397.35 g/mol
LogP4.19
Rot. Bonds3

About 3-(3-chlorophenyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1H-pyrazole-5-carboxamide;hydrochloride

3-(3-chlorophenyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1H-pyrazole-5-carboxamide;hydrochloride (PubChem CID 155970156) has the molecular formula C19H26Cl2N4O and a molecular weight of 397.35 g/mol. Its IUPAC name is 3-(3-chlorophenyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1H-pyrazole-5-carboxamide;hydrochloride.

Molecular Properties

Compound Name3-(3-chlorophenyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1H-pyrazole-5-carboxamide;hydrochloride
PubChem CID155970156
Molecular FormulaC19H26Cl2N4O
Molecular Weight397.35 g/mol
Exact Mass396.15
IUPAC Name3-(3-chlorophenyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1H-pyrazole-5-carboxamide;hydrochloride
SMILESCC1(C)CC(NC(=O)c2cc(-c3cccc(Cl)c3)n[nH]2)CC(C)(C)N1.Cl
InChIInChI=1S/C19H25ClN4O.ClH/c1-18(2)10-14(11-19(3,4)24-18)21-17(25)16-9-15(22-23-16)12-6-5-7-13(20)8-12;/h5-9,14,24H,10-11H2,1-4H3,(H,21,25)(H,22,23);1H
InChIKeyXEGPSMIBVRFJTB-UHFFFAOYSA-N
XLogP4.19
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.35
LogP ≤ 54.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 3-(3-chlorophenyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1H-pyrazole-5-carboxamide;hydrochloride with MolForge

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

Launch Full Analysis

Related Compounds

1-N,3-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)benzene-1,3-dicarboxamide
CID 158461970
N'-(2-chlorobenzoyl)-3-(3-chlorophenyl)-1H-pyrazole-5-carbohydrazide
CID 55624453
2-amino-4-chloro-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzamide
CID 63110103
N-(5-chloro-2-fluorophenyl)-3-(3-chlorophenyl)-1H-pyrazole-5-carboxamide
CID 46920230
5-chloro-2-methoxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzamide
CID 848313
N-(2-chloro-5-fluorophenyl)-3-(3-chlorophenyl)-1H-pyrazole-5-carboxamide
CID 46920191
N-cyclohexyl-3-(3-methoxyphenyl)-1H-pyrazole-5-carboxamide
CID 19509722
3-(3-chlorophenyl)-N-(3-propan-2-ylphenyl)-1H-pyrazole-5-carboxamide
CID 46920141
3-(3-chlorophenyl)-N-(2,4-dimethoxyphenyl)-1H-pyrazole-5-carboxamide
CID 46920150
azepan-1-yl-[3-(3-chlorophenyl)-1H-pyrazol-5-yl]methanone
CID 46920429
5-phenyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,2-oxazole-3-carboxamide
CID 5253507
N'-(2,4-dichlorophenyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide
CID 53326882

Frequently Asked Questions

What is the IUPAC name of 3-(3-chlorophenyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1H-pyrazole-5-carboxamide;hydrochloride?
The IUPAC name of 3-(3-chlorophenyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1H-pyrazole-5-carboxamide;hydrochloride (CID 155970156) is 3-(3-chlorophenyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1H-pyrazole-5-carboxamide;hydrochloride.
What is the SMILES notation for 3-(3-chlorophenyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1H-pyrazole-5-carboxamide;hydrochloride?
The canonical SMILES for 3-(3-chlorophenyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1H-pyrazole-5-carboxamide;hydrochloride is CC1(C)CC(NC(=O)c2cc(-c3cccc(Cl)c3)n[nH]2)CC(C)(C)N1.Cl.
What is the InChIKey of 3-(3-chlorophenyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1H-pyrazole-5-carboxamide;hydrochloride?
The InChIKey is XEGPSMIBVRFJTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25ClN4O.ClH/c1-18(2)10-14(11-19(3,4)24-18)21-17(25)16-9-15(22-23-16)12-6-5-7-13(20)8-12;/h5-9,14,24H,10-11H2,1-4H3,(H,21,25)(H,22,23);1H.
What are the key properties of 3-(3-chlorophenyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1H-pyrazole-5-carboxamide;hydrochloride?
3-(3-chlorophenyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1H-pyrazole-5-carboxamide;hydrochloride has a molecular weight of 397.35 g/mol, XLogP of 4.19, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-chlorophenyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1H-pyrazole-5-carboxamide;hydrochloride is sourced from PubChem (CID 155970156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).