5-cyclopentyl-3-[2-hydroxy-4-[(1-methylpyrrole-2-carbonyl)amino]phenyl]-N-propylpyrazole-1-carboxamide

C24H29N5O3 — CID 154055240

IUPAC5-cyclopentyl-3-[2-hydroxy-4-[(1-methylpyrrole-2-carbonyl)amino]phenyl]-N-propylpyrazole-1-carboxamide
SMILESCCCNC(=O)n1nc(-c2ccc(NC(=O)c3cccn3C)cc2O)cc1C1CCCC1
InChIInChI=1S/C24H29N5O3/c1-3-12-25-24(32)29-21(16-7-4-5-8-16)15-19(27-29)18-11-10-17(14-22(18)30)26-23(31)20-9-6-13-28(20)2/h6,9-11,13-16,30H,3-5,7-8,12H2,1-2H3,(H,25,32)(H,26,31)
InChIKeyLQFNDIJSBVUARN-UHFFFAOYSA-N
MW435.53 g/mol
LogP4.47
Rot. Bonds6

About 5-cyclopentyl-3-[2-hydroxy-4-[(1-methylpyrrole-2-carbonyl)amino]phenyl]-N-propylpyrazole-1-carboxamide

5-cyclopentyl-3-[2-hydroxy-4-[(1-methylpyrrole-2-carbonyl)amino]phenyl]-N-propylpyrazole-1-carboxamide (PubChem CID 154055240) has the molecular formula C24H29N5O3 and a molecular weight of 435.53 g/mol. Its IUPAC name is 5-cyclopentyl-3-[2-hydroxy-4-[(1-methylpyrrole-2-carbonyl)amino]phenyl]-N-propylpyrazole-1-carboxamide.

Molecular Properties

Compound Name5-cyclopentyl-3-[2-hydroxy-4-[(1-methylpyrrole-2-carbonyl)amino]phenyl]-N-propylpyrazole-1-carboxamide
PubChem CID154055240
Molecular FormulaC24H29N5O3
Molecular Weight435.53 g/mol
Exact Mass435.23
IUPAC Name5-cyclopentyl-3-[2-hydroxy-4-[(1-methylpyrrole-2-carbonyl)amino]phenyl]-N-propylpyrazole-1-carboxamide
SMILESCCCNC(=O)n1nc(-c2ccc(NC(=O)c3cccn3C)cc2O)cc1C1CCCC1
InChIInChI=1S/C24H29N5O3/c1-3-12-25-24(32)29-21(16-7-4-5-8-16)15-19(27-29)18-11-10-17(14-22(18)30)26-23(31)20-9-6-13-28(20)2/h6,9-11,13-16,30H,3-5,7-8,12H2,1-2H3,(H,25,32)(H,26,31)
InChIKeyLQFNDIJSBVUARN-UHFFFAOYSA-N
XLogP4.47
TPSA101.18 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500435.53
LogP ≤ 54.47
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

5-cyclobutyl-N-[(2-fluorophenyl)methyl]-3-[2-hydroxy-4-[(1-methylpyrrole-2-carbonyl)amino]phenyl]pyrazole-1-carboxamide
CID 154055245
5-cyclopentyl-3-[2-hydroxy-4-[(4-methylbenzoyl)amino]phenyl]-N-propylpyrazole-1-carboxamide
CID 154055874
5-cyclobutyl-3-[2-hydroxy-4-[(1-methylpyrrole-2-carbonyl)amino]phenyl]-N-[(4-methoxyphenyl)methyl]pyrazole-1-carboxamide
CID 154055247
N-[4-[5-cyclopentyl-1-(propylcarbamoyl)pyrazol-3-yl]-3-hydroxyphenyl]pyridine-3-carboxamide
CID 154055473
5-cyclopentyl-3-[2-hydroxy-5-[(1-methylpyrrole-2-carbonyl)amino]phenyl]-N-[(2-methylphenyl)methyl]pyrazole-1-carboxamide
CID 154054244
5-cyclopropyl-N-[(3-fluorophenyl)methyl]-3-[2-hydroxy-4-[(1-methylpyrrole-2-carbonyl)amino]phenyl]pyrazole-1-carboxamide
CID 154055258
2-chloro-N-[4-[5-cyclopentyl-1-(propylcarbamoyl)pyrazol-3-yl]-3-hydroxyphenyl]pyridine-3-carboxamide
CID 154055345
2-chloro-N-[4-[5-cyclopropyl-1-(propylcarbamoyl)pyrazol-3-yl]-3-hydroxyphenyl]pyridine-3-carboxamide
CID 154055372
5-cyclobutyl-3-[2-hydroxy-5-(thiophene-2-carbonylamino)phenyl]-N-propylpyrazole-1-carboxamide
CID 154054598
5-cyclopentyl-3-[2-hydroxy-4-(propanoylamino)phenyl]-N-propan-2-ylpyrazole-1-carboxamide
CID 154055712
5-cyclobutyl-N-ethyl-3-[4-(furan-2-carbonylamino)-2-hydroxyphenyl]pyrazole-1-carboxamide
CID 154055654
5-cyclopropyl-3-[5-[(4-ethylbenzoyl)amino]-2-hydroxyphenyl]-N-propylpyrazole-1-carboxamide
CID 154054872

Frequently Asked Questions

What is the IUPAC name of 5-cyclopentyl-3-[2-hydroxy-4-[(1-methylpyrrole-2-carbonyl)amino]phenyl]-N-propylpyrazole-1-carboxamide?
The IUPAC name of 5-cyclopentyl-3-[2-hydroxy-4-[(1-methylpyrrole-2-carbonyl)amino]phenyl]-N-propylpyrazole-1-carboxamide (CID 154055240) is 5-cyclopentyl-3-[2-hydroxy-4-[(1-methylpyrrole-2-carbonyl)amino]phenyl]-N-propylpyrazole-1-carboxamide.
What is the SMILES notation for 5-cyclopentyl-3-[2-hydroxy-4-[(1-methylpyrrole-2-carbonyl)amino]phenyl]-N-propylpyrazole-1-carboxamide?
The canonical SMILES for 5-cyclopentyl-3-[2-hydroxy-4-[(1-methylpyrrole-2-carbonyl)amino]phenyl]-N-propylpyrazole-1-carboxamide is CCCNC(=O)n1nc(-c2ccc(NC(=O)c3cccn3C)cc2O)cc1C1CCCC1.
What is the InChIKey of 5-cyclopentyl-3-[2-hydroxy-4-[(1-methylpyrrole-2-carbonyl)amino]phenyl]-N-propylpyrazole-1-carboxamide?
The InChIKey is LQFNDIJSBVUARN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29N5O3/c1-3-12-25-24(32)29-21(16-7-4-5-8-16)15-19(27-29)18-11-10-17(14-22(18)30)26-23(31)20-9-6-13-28(20)2/h6,9-11,13-16,30H,3-5,7-8,12H2,1-2H3,(H,25,32)(H,26,31).
What are the key properties of 5-cyclopentyl-3-[2-hydroxy-4-[(1-methylpyrrole-2-carbonyl)amino]phenyl]-N-propylpyrazole-1-carboxamide?
5-cyclopentyl-3-[2-hydroxy-4-[(1-methylpyrrole-2-carbonyl)amino]phenyl]-N-propylpyrazole-1-carboxamide has a molecular weight of 435.53 g/mol, XLogP of 4.47, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopentyl-3-[2-hydroxy-4-[(1-methylpyrrole-2-carbonyl)amino]phenyl]-N-propylpyrazole-1-carboxamide is sourced from PubChem (CID 154055240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).