(6S)-5-(5-chloro-2-methylphenyl)-N-cyclohexyl-6-methyl-4-oxo-2-propan-2-yl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide

C24H31ClN4O2 — CID 92738788

IUPAC(6S)-5-(5-chloro-2-methylphenyl)-N-cyclohexyl-6-methyl-4-oxo-2-propan-2-yl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide
SMILESCc1ccc(Cl)cc1N1C(=O)c2cc(C(C)C)nn2C[C@@]1(C)C(=O)NC1CCCCC1
InChIInChI=1S/C24H31ClN4O2/c1-15(2)19-13-21-22(30)29(20-12-17(25)11-10-16(20)3)24(4,14-28(21)27-19)23(31)26-18-8-6-5-7-9-18/h10-13,15,18H,5-9,14H2,1-4H3,(H,26,31)/t24-/m0/s1
InChIKeyDNLYXTDJRRHVMI-DEOSSOPVSA-N
MW442.99 g/mol
LogP4.84
Rot. Bonds4

About (6S)-5-(5-chloro-2-methylphenyl)-N-cyclohexyl-6-methyl-4-oxo-2-propan-2-yl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide

(6S)-5-(5-chloro-2-methylphenyl)-N-cyclohexyl-6-methyl-4-oxo-2-propan-2-yl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide (PubChem CID 92738788) has the molecular formula C24H31ClN4O2 and a molecular weight of 442.99 g/mol. Its IUPAC name is (6S)-5-(5-chloro-2-methylphenyl)-N-cyclohexyl-6-methyl-4-oxo-2-propan-2-yl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide.

Molecular Properties

Compound Name(6S)-5-(5-chloro-2-methylphenyl)-N-cyclohexyl-6-methyl-4-oxo-2-propan-2-yl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide
PubChem CID92738788
Molecular FormulaC24H31ClN4O2
Molecular Weight442.99 g/mol
Exact Mass442.21
IUPAC Name(6S)-5-(5-chloro-2-methylphenyl)-N-cyclohexyl-6-methyl-4-oxo-2-propan-2-yl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide
SMILESCc1ccc(Cl)cc1N1C(=O)c2cc(C(C)C)nn2C[C@@]1(C)C(=O)NC1CCCCC1
InChIInChI=1S/C24H31ClN4O2/c1-15(2)19-13-21-22(30)29(20-12-17(25)11-10-16(20)3)24(4,14-28(21)27-19)23(31)26-18-8-6-5-7-9-18/h10-13,15,18H,5-9,14H2,1-4H3,(H,26,31)/t24-/m0/s1
InChIKeyDNLYXTDJRRHVMI-DEOSSOPVSA-N
XLogP4.84
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500442.99
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (6S)-5-(5-chloro-2-methylphenyl)-N-cyclohexyl-6-methyl-4-oxo-2-propan-2-yl-7H-pyrazolo[1,5-a]pyrazine-6-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

(6S)-5-(3-chlorophenyl)-N-cycloheptyl-6-methyl-4-oxo-2-propan-2-yl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide
CID 92738854
5-(3-chlorophenyl)-N-cycloheptyl-6-methyl-4-oxo-2-propan-2-yl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide
CID 46272632
(6R)-5-(3-chlorophenyl)-N-cycloheptyl-6-methyl-4-oxo-2-propan-2-yl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide
CID 92738853
(6R)-5-[(4-chlorophenyl)methyl]-N-cyclohexyl-6-methyl-4-oxo-2-propan-2-yl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide
CID 92738785
N-cyclohexyl-5-(4-methoxyphenyl)-6-methyl-4-oxo-2-propan-2-yl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide
CID 71172126
methyl (6R)-5-(4-chloro-2-methylphenyl)-6-(cyclopentylcarbamoyl)-6-methyl-4-oxo-7H-pyrazolo[1,5-a]pyrazine-2-carboxylate
CID 92744574
(6S)-N-cyclohexyl-6-methyl-5-(2-methylphenyl)-4-oxo-2-(4-propan-2-ylphenyl)-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide
CID 92704003
N-cyclooctyl-5-[(4-fluorophenyl)methyl]-6-methyl-4-oxo-2-propan-2-yl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide
CID 22522330
(11S)-10-(5-chloro-2-methylphenyl)-N-cyclohexyl-11-methyl-9-oxo-5-oxa-1,10-diazatricyclo[6.4.0.02,6]dodeca-2(6),3,7-triene-11-carboxamide
CID 92737541
2-tert-butyl-N-cyclohexyl-6-methyl-5-(2-methylphenyl)-4-oxo-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide
CID 50756568
5-[(2-chlorophenyl)methyl]-N-cycloheptyl-6-methyl-4-oxo-2-propan-2-yl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide
CID 46272634
(6R)-5-(4-chloro-2-methylphenyl)-N-cyclopentyl-6-methyl-4-oxo-2-thiophen-2-yl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide
CID 95062689

Frequently Asked Questions

What is the IUPAC name of (6S)-5-(5-chloro-2-methylphenyl)-N-cyclohexyl-6-methyl-4-oxo-2-propan-2-yl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide?
The IUPAC name of (6S)-5-(5-chloro-2-methylphenyl)-N-cyclohexyl-6-methyl-4-oxo-2-propan-2-yl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide (CID 92738788) is (6S)-5-(5-chloro-2-methylphenyl)-N-cyclohexyl-6-methyl-4-oxo-2-propan-2-yl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide.
What is the SMILES notation for (6S)-5-(5-chloro-2-methylphenyl)-N-cyclohexyl-6-methyl-4-oxo-2-propan-2-yl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide?
The canonical SMILES for (6S)-5-(5-chloro-2-methylphenyl)-N-cyclohexyl-6-methyl-4-oxo-2-propan-2-yl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide is Cc1ccc(Cl)cc1N1C(=O)c2cc(C(C)C)nn2C[C@@]1(C)C(=O)NC1CCCCC1.
What is the InChIKey of (6S)-5-(5-chloro-2-methylphenyl)-N-cyclohexyl-6-methyl-4-oxo-2-propan-2-yl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide?
The InChIKey is DNLYXTDJRRHVMI-DEOSSOPVSA-N. The full InChI is InChI=1S/C24H31ClN4O2/c1-15(2)19-13-21-22(30)29(20-12-17(25)11-10-16(20)3)24(4,14-28(21)27-19)23(31)26-18-8-6-5-7-9-18/h10-13,15,18H,5-9,14H2,1-4H3,(H,26,31)/t24-/m0/s1.
What are the key properties of (6S)-5-(5-chloro-2-methylphenyl)-N-cyclohexyl-6-methyl-4-oxo-2-propan-2-yl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide?
(6S)-5-(5-chloro-2-methylphenyl)-N-cyclohexyl-6-methyl-4-oxo-2-propan-2-yl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide has a molecular weight of 442.99 g/mol, XLogP of 4.84, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6S)-5-(5-chloro-2-methylphenyl)-N-cyclohexyl-6-methyl-4-oxo-2-propan-2-yl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide is sourced from PubChem (CID 92738788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).