N-[2-cyclohexyl-6-(2-hydroxypropan-2-yl)indazol-5-yl]formamide

C17H23N3O2 — CID 167156213

IUPACN-[2-cyclohexyl-6-(2-hydroxypropan-2-yl)indazol-5-yl]formamide
SMILESCC(C)(O)c1cc2nn(C3CCCCC3)cc2cc1NC=O
InChIInChI=1S/C17H23N3O2/c1-17(2,22)14-9-15-12(8-16(14)18-11-21)10-20(19-15)13-6-4-3-5-7-13/h8-11,13,22H,3-7H2,1-2H3,(H,18,21)
InChIKeyITVUGVBWHIQPGA-UHFFFAOYSA-N
MW301.39 g/mol
LogP3.34
Rot. Bonds4

About N-[2-cyclohexyl-6-(2-hydroxypropan-2-yl)indazol-5-yl]formamide

N-[2-cyclohexyl-6-(2-hydroxypropan-2-yl)indazol-5-yl]formamide (PubChem CID 167156213) has the molecular formula C17H23N3O2 and a molecular weight of 301.39 g/mol. Its IUPAC name is N-[2-cyclohexyl-6-(2-hydroxypropan-2-yl)indazol-5-yl]formamide.

Molecular Properties

Compound NameN-[2-cyclohexyl-6-(2-hydroxypropan-2-yl)indazol-5-yl]formamide
PubChem CID167156213
Molecular FormulaC17H23N3O2
Molecular Weight301.39 g/mol
Exact Mass301.18
IUPAC NameN-[2-cyclohexyl-6-(2-hydroxypropan-2-yl)indazol-5-yl]formamide
SMILESCC(C)(O)c1cc2nn(C3CCCCC3)cc2cc1NC=O
InChIInChI=1S/C17H23N3O2/c1-17(2,22)14-9-15-12(8-16(14)18-11-21)10-20(19-15)13-6-4-3-5-7-13/h8-11,13,22H,3-7H2,1-2H3,(H,18,21)
InChIKeyITVUGVBWHIQPGA-UHFFFAOYSA-N
XLogP3.34
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 53.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

3,4-dichloro-N-[2-cyclohexyl-6-(2-hydroxypropan-2-yl)indazol-5-yl]benzamide
CID 155751992
N-[2-cyclohexyl-6-(2-hydroxypropan-2-yl)indazol-5-yl]-2-methyl-1,3-oxazole-4-carboxamide
CID 164567526
3,4-dichloro-N-[2-cyclohexyl-6-(2-hydroxypropan-2-yl)indazol-5-yl]benzamide;formaldehyde
CID 155751991
N-[2-cyclohexyl-6-(2-hydroxypropan-2-yl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
CID 155448858
4-[6-(2-hydroxypropan-2-yl)-5-[(2-methyl-1,3-oxazol-4-yl)methylamino]indazol-2-yl]cyclohexane-1-carbaldehyde
CID 167156787
N-[2-(4-formylcyclohexyl)-6-(2-hydroxypropan-2-yl)indazol-5-yl]-6-methylpyridine-2-carboxamide
CID 155437780
N-[2-(4-formylcyclohexyl)-6-(2-hydroxypropan-2-yl)indazol-5-yl]-6-methoxypyridine-2-carboxamide
CID 155437843
N-[6-(2-hydroxypropan-2-yl)-2-(4-methylcyclohexyl)indazol-5-yl]pyridine-2-carboxamide
CID 167156198
N-[2-(4-formylcyclohexyl)-6-(2-hydroxypropan-2-yl)indazol-5-yl]-3-(trifluoromethyl)pyridine-2-carboxamide
CID 168854236
6-tert-butyl-N-[6-(2-hydroxypropan-2-yl)-2-(4-methylcyclohexyl)indazol-5-yl]pyridine-2-carboxamide
CID 170240012
N-[6-(2-hydroxypropan-2-yl)-2-(4-methylcyclohexyl)indazol-5-yl]-2-(trifluoromethyl)pyrimidine-5-carboxamide
CID 155448913
N-[2-(4-ethylcyclohexyl)-6-(2-hydroxypropan-2-yl)indazol-5-yl]pyridine-2-carboxamide
CID 155448898

Frequently Asked Questions

What is the IUPAC name of N-[2-cyclohexyl-6-(2-hydroxypropan-2-yl)indazol-5-yl]formamide?
The IUPAC name of N-[2-cyclohexyl-6-(2-hydroxypropan-2-yl)indazol-5-yl]formamide (CID 167156213) is N-[2-cyclohexyl-6-(2-hydroxypropan-2-yl)indazol-5-yl]formamide.
What is the SMILES notation for N-[2-cyclohexyl-6-(2-hydroxypropan-2-yl)indazol-5-yl]formamide?
The canonical SMILES for N-[2-cyclohexyl-6-(2-hydroxypropan-2-yl)indazol-5-yl]formamide is CC(C)(O)c1cc2nn(C3CCCCC3)cc2cc1NC=O.
What is the InChIKey of N-[2-cyclohexyl-6-(2-hydroxypropan-2-yl)indazol-5-yl]formamide?
The InChIKey is ITVUGVBWHIQPGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O2/c1-17(2,22)14-9-15-12(8-16(14)18-11-21)10-20(19-15)13-6-4-3-5-7-13/h8-11,13,22H,3-7H2,1-2H3,(H,18,21).
What are the key properties of N-[2-cyclohexyl-6-(2-hydroxypropan-2-yl)indazol-5-yl]formamide?
N-[2-cyclohexyl-6-(2-hydroxypropan-2-yl)indazol-5-yl]formamide has a molecular weight of 301.39 g/mol, XLogP of 3.34, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-cyclohexyl-6-(2-hydroxypropan-2-yl)indazol-5-yl]formamide is sourced from PubChem (CID 167156213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).