5-chloro-1,3-dimethyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]pyrazole-4-carboxamide

C14H22ClN5O2 — CID 32529148

IUPAC5-chloro-1,3-dimethyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]pyrazole-4-carboxamide
SMILESCNC(=O)CN1CCC(NC(=O)c2c(C)nn(C)c2Cl)CC1
InChIInChI=1S/C14H22ClN5O2/c1-9-12(13(15)19(3)18-9)14(22)17-10-4-6-20(7-5-10)8-11(21)16-2/h10H,4-8H2,1-3H3,(H,16,21)(H,17,22)
InChIKeyPRBTXRCGSGAQEE-UHFFFAOYSA-N
MW327.82 g/mol
LogP0.32
Rot. Bonds4

About 5-chloro-1,3-dimethyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]pyrazole-4-carboxamide

5-chloro-1,3-dimethyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]pyrazole-4-carboxamide (PubChem CID 32529148) has the molecular formula C14H22ClN5O2 and a molecular weight of 327.82 g/mol. Its IUPAC name is 5-chloro-1,3-dimethyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-chloro-1,3-dimethyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]pyrazole-4-carboxamide
PubChem CID32529148
Molecular FormulaC14H22ClN5O2
Molecular Weight327.82 g/mol
Exact Mass327.15
IUPAC Name5-chloro-1,3-dimethyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]pyrazole-4-carboxamide
SMILESCNC(=O)CN1CCC(NC(=O)c2c(C)nn(C)c2Cl)CC1
InChIInChI=1S/C14H22ClN5O2/c1-9-12(13(15)19(3)18-9)14(22)17-10-4-6-20(7-5-10)8-11(21)16-2/h10H,4-8H2,1-3H3,(H,16,21)(H,17,22)
InChIKeyPRBTXRCGSGAQEE-UHFFFAOYSA-N
XLogP0.32
TPSA79.26 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.82
LogP ≤ 50.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 5-chloro-1,3-dimethyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]pyrazole-4-carboxamide 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

3-methyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]-5-propan-2-yl-1,2-oxazole-4-carboxamide
CID 32527060
1-methyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]pyrazole-4-carboxamide
CID 47170090
N-[1-(cyanomethyl)piperidin-4-yl]-1,3,5-trimethylpyrazole-4-carboxamide
CID 63627481
3-methyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]imidazo[2,1-b][1,3]thiazole-2-carboxamide
CID 154737089
3-methyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]-1,2-oxazole-5-carboxamide
CID 47170091
2-amino-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]acetamide
CID 43704790
5-chloro-1,3-dimethyl-N-(2-morpholin-4-ylethyl)pyrazole-4-carboxamide
CID 47141788
1-benzyl-5-chloro-N-(1-ethylpiperidin-4-yl)-3-methylpyrazole-4-carboxamide
CID 30768138
2,2-dimethyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]propanamide
CID 60751395
3-(cyclopropylamino)-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]propanamide
CID 60866717
5-chloro-N-methoxy-1,3-dimethylpyrazole-4-carboxamide
CID 47143740
N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]-1-phenylpyrazole-3-carboxamide
CID 51078940

Frequently Asked Questions

What is the IUPAC name of 5-chloro-1,3-dimethyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]pyrazole-4-carboxamide?
The IUPAC name of 5-chloro-1,3-dimethyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]pyrazole-4-carboxamide (CID 32529148) is 5-chloro-1,3-dimethyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]pyrazole-4-carboxamide.
What is the SMILES notation for 5-chloro-1,3-dimethyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]pyrazole-4-carboxamide?
The canonical SMILES for 5-chloro-1,3-dimethyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]pyrazole-4-carboxamide is CNC(=O)CN1CCC(NC(=O)c2c(C)nn(C)c2Cl)CC1.
What is the InChIKey of 5-chloro-1,3-dimethyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]pyrazole-4-carboxamide?
The InChIKey is PRBTXRCGSGAQEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22ClN5O2/c1-9-12(13(15)19(3)18-9)14(22)17-10-4-6-20(7-5-10)8-11(21)16-2/h10H,4-8H2,1-3H3,(H,16,21)(H,17,22).
What are the key properties of 5-chloro-1,3-dimethyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]pyrazole-4-carboxamide?
5-chloro-1,3-dimethyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]pyrazole-4-carboxamide has a molecular weight of 327.82 g/mol, XLogP of 0.32, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-1,3-dimethyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]pyrazole-4-carboxamide is sourced from PubChem (CID 32529148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).