1-cyclohexyl-N-(1H-indazol-6-yl)-5-oxopyrrolidine-3-carboxamide

C18H22N4O2 — CID 110678542

IUPAC1-cyclohexyl-N-(1H-indazol-6-yl)-5-oxopyrrolidine-3-carboxamide
SMILESO=C(Nc1ccc2cn[nH]c2c1)C1CC(=O)N(C2CCCCC2)C1
InChIInChI=1S/C18H22N4O2/c23-17-8-13(11-22(17)15-4-2-1-3-5-15)18(24)20-14-7-6-12-10-19-21-16(12)9-14/h6-7,9-10,13,15H,1-5,8,11H2,(H,19,21)(H,20,24)
InChIKeyCWEYZLLLESZVCF-UHFFFAOYSA-N
MW326.40 g/mol
LogP2.68
Rot. Bonds3

About 1-cyclohexyl-N-(1H-indazol-6-yl)-5-oxopyrrolidine-3-carboxamide

1-cyclohexyl-N-(1H-indazol-6-yl)-5-oxopyrrolidine-3-carboxamide (PubChem CID 110678542) has the molecular formula C18H22N4O2 and a molecular weight of 326.40 g/mol. Its IUPAC name is 1-cyclohexyl-N-(1H-indazol-6-yl)-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound Name1-cyclohexyl-N-(1H-indazol-6-yl)-5-oxopyrrolidine-3-carboxamide
PubChem CID110678542
Molecular FormulaC18H22N4O2
Molecular Weight326.40 g/mol
Exact Mass326.17
IUPAC Name1-cyclohexyl-N-(1H-indazol-6-yl)-5-oxopyrrolidine-3-carboxamide
SMILESO=C(Nc1ccc2cn[nH]c2c1)C1CC(=O)N(C2CCCCC2)C1
InChIInChI=1S/C18H22N4O2/c23-17-8-13(11-22(17)15-4-2-1-3-5-15)18(24)20-14-7-6-12-10-19-21-16(12)9-14/h6-7,9-10,13,15H,1-5,8,11H2,(H,19,21)(H,20,24)
InChIKeyCWEYZLLLESZVCF-UHFFFAOYSA-N
XLogP2.68
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-1-cyclohexyl-N-naphthalen-2-yl-5-oxopyrrolidine-3-carboxamide
CID 675322
N-(1H-indazol-6-yl)-5-oxo-1-pyridin-3-ylpyrrolidine-3-carboxamide
CID 110684595
N-(4-acetamidophenyl)-1-cycloheptyl-5-oxopyrrolidine-3-carboxamide
CID 113185550
1-cyclobutyl-N-(3,4-dichlorophenyl)-5-oxopyrrolidine-3-carboxamide
CID 110687616
1-cyclopentyl-N-[3-(cyclopropanecarbonylamino)phenyl]-5-oxopyrrolidine-3-carboxamide
CID 46568551
(3R)-1-cyclohexyl-N-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 40596002
(3S)-1-cyclohexyl-5-oxo-N-phenylpyrrolidine-3-carboxamide
CID 2266114
(3R)-1-cycloheptyl-5-oxo-N-(1H-pyrazol-5-yl)pyrrolidine-3-carboxamide
CID 95299279
N-(1H-indazol-6-yl)-1-(2-methoxy-5-methylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 108788368
N-(1H-indazol-6-yl)bicyclo[4.1.0]heptane-7-carboxamide
CID 136529699
(3S)-N-(3-bromophenyl)-1-cyclohexyl-5-oxopyrrolidine-3-carboxamide
CID 1116191
(3S)-N-(4-acetylphenyl)-1-cyclohexyl-5-oxopyrrolidine-3-carboxamide
CID 802193

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-(1H-indazol-6-yl)-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of 1-cyclohexyl-N-(1H-indazol-6-yl)-5-oxopyrrolidine-3-carboxamide (CID 110678542) is 1-cyclohexyl-N-(1H-indazol-6-yl)-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for 1-cyclohexyl-N-(1H-indazol-6-yl)-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for 1-cyclohexyl-N-(1H-indazol-6-yl)-5-oxopyrrolidine-3-carboxamide is O=C(Nc1ccc2cn[nH]c2c1)C1CC(=O)N(C2CCCCC2)C1.
What is the InChIKey of 1-cyclohexyl-N-(1H-indazol-6-yl)-5-oxopyrrolidine-3-carboxamide?
The InChIKey is CWEYZLLLESZVCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4O2/c23-17-8-13(11-22(17)15-4-2-1-3-5-15)18(24)20-14-7-6-12-10-19-21-16(12)9-14/h6-7,9-10,13,15H,1-5,8,11H2,(H,19,21)(H,20,24).
What are the key properties of 1-cyclohexyl-N-(1H-indazol-6-yl)-5-oxopyrrolidine-3-carboxamide?
1-cyclohexyl-N-(1H-indazol-6-yl)-5-oxopyrrolidine-3-carboxamide has a molecular weight of 326.40 g/mol, XLogP of 2.68, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-(1H-indazol-6-yl)-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 110678542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).