4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]-N-[(1-methylpiperidin-4-yl)methyl]piperazine-1-carboxamide

C24H30ClN7O — CID 71516513

IUPAC4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]-N-[(1-methylpiperidin-4-yl)methyl]piperazine-1-carboxamide
SMILESCN1CCC(CNC(=O)N2CCN(c3nn(-c4ccc(Cl)cc4)c4cnccc34)CC2)CC1
InChIInChI=1S/C24H30ClN7O/c1-29-10-7-18(8-11-29)16-27-24(33)31-14-12-30(13-15-31)23-21-6-9-26-17-22(21)32(28-23)20-4-2-19(25)3-5-20/h2-6,9,17-18H,7-8,10-16H2,1H3,(H,27,33)
InChIKeyGCMFKUDDFYCBBM-UHFFFAOYSA-N
MW468.01 g/mol
LogP3.25
Rot. Bonds4

About 4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]-N-[(1-methylpiperidin-4-yl)methyl]piperazine-1-carboxamide

4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]-N-[(1-methylpiperidin-4-yl)methyl]piperazine-1-carboxamide (PubChem CID 71516513) has the molecular formula C24H30ClN7O and a molecular weight of 468.01 g/mol. Its IUPAC name is 4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]-N-[(1-methylpiperidin-4-yl)methyl]piperazine-1-carboxamide.

Molecular Properties

Compound Name4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]-N-[(1-methylpiperidin-4-yl)methyl]piperazine-1-carboxamide
PubChem CID71516513
Molecular FormulaC24H30ClN7O
Molecular Weight468.01 g/mol
Exact Mass467.22
IUPAC Name4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]-N-[(1-methylpiperidin-4-yl)methyl]piperazine-1-carboxamide
SMILESCN1CCC(CNC(=O)N2CCN(c3nn(-c4ccc(Cl)cc4)c4cnccc34)CC2)CC1
InChIInChI=1S/C24H30ClN7O/c1-29-10-7-18(8-11-29)16-27-24(33)31-14-12-30(13-15-31)23-21-6-9-26-17-22(21)32(28-23)20-4-2-19(25)3-5-20/h2-6,9,17-18H,7-8,10-16H2,1H3,(H,27,33)
InChIKeyGCMFKUDDFYCBBM-UHFFFAOYSA-N
XLogP3.25
TPSA69.53 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500468.01
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]-N-[(1-methylpiperidin-4-yl)methyl]piperazine-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 4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]-N-[(1-methylpiperidin-4-yl)methyl]piperazine-1-carboxamide?
The IUPAC name of 4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]-N-[(1-methylpiperidin-4-yl)methyl]piperazine-1-carboxamide (CID 71516513) is 4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]-N-[(1-methylpiperidin-4-yl)methyl]piperazine-1-carboxamide.
What is the SMILES notation for 4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]-N-[(1-methylpiperidin-4-yl)methyl]piperazine-1-carboxamide?
The canonical SMILES for 4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]-N-[(1-methylpiperidin-4-yl)methyl]piperazine-1-carboxamide is CN1CCC(CNC(=O)N2CCN(c3nn(-c4ccc(Cl)cc4)c4cnccc34)CC2)CC1.
What is the InChIKey of 4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]-N-[(1-methylpiperidin-4-yl)methyl]piperazine-1-carboxamide?
The InChIKey is GCMFKUDDFYCBBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30ClN7O/c1-29-10-7-18(8-11-29)16-27-24(33)31-14-12-30(13-15-31)23-21-6-9-26-17-22(21)32(28-23)20-4-2-19(25)3-5-20/h2-6,9,17-18H,7-8,10-16H2,1H3,(H,27,33).
What are the key properties of 4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]-N-[(1-methylpiperidin-4-yl)methyl]piperazine-1-carboxamide?
4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]-N-[(1-methylpiperidin-4-yl)methyl]piperazine-1-carboxamide has a molecular weight of 468.01 g/mol, XLogP of 3.25, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]-N-[(1-methylpiperidin-4-yl)methyl]piperazine-1-carboxamide is sourced from PubChem (CID 71516513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).