1-[4-(3-chlorophenyl)-1-methylpyrrolidin-3-yl]-3-[3-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]pyridin-6-yl]urea

C24H24ClN7O — CID 123954144

IUPAC1-[4-(3-chlorophenyl)-1-methylpyrrolidin-3-yl]-3-[3-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]pyridin-6-yl]urea
SMILESCc1cc(-c2n[nH]c3cc(NC(=O)NC4CN(C)CC4c4cccc(Cl)c4)ncc23)ccn1
InChIInChI=1S/C24H24ClN7O/c1-14-8-16(6-7-26-14)23-18-11-27-22(10-20(18)30-31-23)29-24(33)28-21-13-32(2)12-19(21)15-4-3-5-17(25)9-15/h3-11,19,21H,12-13H2,1-2H3,(H,30,31)(H2,27,28,29,33)
InChIKeyCRIVIQPSWOXPDX-UHFFFAOYSA-N
MW461.96 g/mol
LogP4.20
Rot. Bonds4

About 1-[4-(3-chlorophenyl)-1-methylpyrrolidin-3-yl]-3-[3-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]pyridin-6-yl]urea

1-[4-(3-chlorophenyl)-1-methylpyrrolidin-3-yl]-3-[3-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]pyridin-6-yl]urea (PubChem CID 123954144) has the molecular formula C24H24ClN7O and a molecular weight of 461.96 g/mol. Its IUPAC name is 1-[4-(3-chlorophenyl)-1-methylpyrrolidin-3-yl]-3-[3-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]pyridin-6-yl]urea.

Molecular Properties

Compound Name1-[4-(3-chlorophenyl)-1-methylpyrrolidin-3-yl]-3-[3-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]pyridin-6-yl]urea
PubChem CID123954144
Molecular FormulaC24H24ClN7O
Molecular Weight461.96 g/mol
Exact Mass461.17
IUPAC Name1-[4-(3-chlorophenyl)-1-methylpyrrolidin-3-yl]-3-[3-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]pyridin-6-yl]urea
SMILESCc1cc(-c2n[nH]c3cc(NC(=O)NC4CN(C)CC4c4cccc(Cl)c4)ncc23)ccn1
InChIInChI=1S/C24H24ClN7O/c1-14-8-16(6-7-26-14)23-18-11-27-22(10-20(18)30-31-23)29-24(33)28-21-13-32(2)12-19(21)15-4-3-5-17(25)9-15/h3-11,19,21H,12-13H2,1-2H3,(H,30,31)(H2,27,28,29,33)
InChIKeyCRIVIQPSWOXPDX-UHFFFAOYSA-N
XLogP4.20
TPSA98.83 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500461.96
LogP ≤ 54.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 1-[4-(3-chlorophenyl)-1-methylpyrrolidin-3-yl]-3-[3-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]pyridin-6-yl]urea 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 1-[4-(3-chlorophenyl)-1-methylpyrrolidin-3-yl]-3-[3-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]pyridin-6-yl]urea?
The IUPAC name of 1-[4-(3-chlorophenyl)-1-methylpyrrolidin-3-yl]-3-[3-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]pyridin-6-yl]urea (CID 123954144) is 1-[4-(3-chlorophenyl)-1-methylpyrrolidin-3-yl]-3-[3-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]pyridin-6-yl]urea.
What is the SMILES notation for 1-[4-(3-chlorophenyl)-1-methylpyrrolidin-3-yl]-3-[3-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]pyridin-6-yl]urea?
The canonical SMILES for 1-[4-(3-chlorophenyl)-1-methylpyrrolidin-3-yl]-3-[3-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]pyridin-6-yl]urea is Cc1cc(-c2n[nH]c3cc(NC(=O)NC4CN(C)CC4c4cccc(Cl)c4)ncc23)ccn1.
What is the InChIKey of 1-[4-(3-chlorophenyl)-1-methylpyrrolidin-3-yl]-3-[3-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]pyridin-6-yl]urea?
The InChIKey is CRIVIQPSWOXPDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24ClN7O/c1-14-8-16(6-7-26-14)23-18-11-27-22(10-20(18)30-31-23)29-24(33)28-21-13-32(2)12-19(21)15-4-3-5-17(25)9-15/h3-11,19,21H,12-13H2,1-2H3,(H,30,31)(H2,27,28,29,33).
What are the key properties of 1-[4-(3-chlorophenyl)-1-methylpyrrolidin-3-yl]-3-[3-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]pyridin-6-yl]urea?
1-[4-(3-chlorophenyl)-1-methylpyrrolidin-3-yl]-3-[3-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]pyridin-6-yl]urea has a molecular weight of 461.96 g/mol, XLogP of 4.20, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(3-chlorophenyl)-1-methylpyrrolidin-3-yl]-3-[3-(2-methyl-4-pyridinyl)-1H-pyrazolo[4,3-c]pyridin-6-yl]urea is sourced from PubChem (CID 123954144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).