N-[(1R,2R)-2-hydroxycyclohexyl]-1-methylindazole-3-carboxamide

C15H19N3O2 — CID 103120378

IUPACN-[(1R,2R)-2-hydroxycyclohexyl]-1-methylindazole-3-carboxamide
SMILESCn1nc(C(=O)N[C@@H]2CCCC[C@H]2O)c2ccccc21
InChIInChI=1S/C15H19N3O2/c1-18-12-8-4-2-6-10(12)14(17-18)15(20)16-11-7-3-5-9-13(11)19/h2,4,6,8,11,13,19H,3,5,7,9H2,1H3,(H,16,20)/t11-,13-/m1/s1
InChIKeyFXCXQEBPOJPKJN-DGCLKSJQSA-N
MW273.34 g/mol
LogP1.61
Rot. Bonds2

About N-[(1R,2R)-2-hydroxycyclohexyl]-1-methylindazole-3-carboxamide

N-[(1R,2R)-2-hydroxycyclohexyl]-1-methylindazole-3-carboxamide (PubChem CID 103120378) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is N-[(1R,2R)-2-hydroxycyclohexyl]-1-methylindazole-3-carboxamide.

Molecular Properties

Compound NameN-[(1R,2R)-2-hydroxycyclohexyl]-1-methylindazole-3-carboxamide
PubChem CID103120378
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC NameN-[(1R,2R)-2-hydroxycyclohexyl]-1-methylindazole-3-carboxamide
SMILESCn1nc(C(=O)N[C@@H]2CCCC[C@H]2O)c2ccccc21
InChIInChI=1S/C15H19N3O2/c1-18-12-8-4-2-6-10(12)14(17-18)15(20)16-11-7-3-5-9-13(11)19/h2,4,6,8,11,13,19H,3,5,7,9H2,1H3,(H,16,20)/t11-,13-/m1/s1
InChIKeyFXCXQEBPOJPKJN-DGCLKSJQSA-N
XLogP1.61
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-hydroxycyclohexyl)-1-methylindazole-3-carboxamide
CID 103120150
N-(2-aminocyclopropyl)-1-methylindazole-3-carboxamide
CID 103120569
1-methyl-N-(4-methylpyrrolidin-3-yl)indazole-3-carboxamide
CID 103117381
1-methyl-N-(4-oxocyclohexyl)indazole-3-carboxamide
CID 103118179
1-methyl-N-[(1R,5S)-9-methyl-9-azabicyclo[3.3.1]nonan-3-yl]indazole-3-carboxamide;hydrochloride
CID 6918003
N-(4-chloro-1,1-dioxothiolan-3-yl)-1-methylindazole-3-carboxamide
CID 103119724
N-(2-bromo-4-methylidenecyclohexyl)-1-methylindazole-3-carboxamide
CID 91413748
methanesulfonic acid;1-methyl-N-[(1S,5S)-9-methyl-9-azabicyclo[3.3.1]nonan-3-yl]indazole-3-carboxamide
CID 71728255
1-methyl-N-[(1S,5S)-9-methyl-9-azabicyclo[3.3.1]nonan-3-yl]indazole-3-carboxamide;sulfuric acid
CID 46912690
4-fluoro-N-[(1S,2S)-2-hydroxycyclohexyl]-1-[(1-methylindazol-3-yl)methyl]indole-3-carboxamide
CID 138644469
cyclobutyl-(1-methylindazol-3-yl)methanone
CID 103125487
N-(2,2-dimethyl-1-azabicyclo[2.2.2]octan-3-yl)-1-methylindazole-3-carboxamide
CID 121413863

Frequently Asked Questions

What is the IUPAC name of N-[(1R,2R)-2-hydroxycyclohexyl]-1-methylindazole-3-carboxamide?
The IUPAC name of N-[(1R,2R)-2-hydroxycyclohexyl]-1-methylindazole-3-carboxamide (CID 103120378) is N-[(1R,2R)-2-hydroxycyclohexyl]-1-methylindazole-3-carboxamide.
What is the SMILES notation for N-[(1R,2R)-2-hydroxycyclohexyl]-1-methylindazole-3-carboxamide?
The canonical SMILES for N-[(1R,2R)-2-hydroxycyclohexyl]-1-methylindazole-3-carboxamide is Cn1nc(C(=O)N[C@@H]2CCCC[C@H]2O)c2ccccc21.
What is the InChIKey of N-[(1R,2R)-2-hydroxycyclohexyl]-1-methylindazole-3-carboxamide?
The InChIKey is FXCXQEBPOJPKJN-DGCLKSJQSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-18-12-8-4-2-6-10(12)14(17-18)15(20)16-11-7-3-5-9-13(11)19/h2,4,6,8,11,13,19H,3,5,7,9H2,1H3,(H,16,20)/t11-,13-/m1/s1.
What are the key properties of N-[(1R,2R)-2-hydroxycyclohexyl]-1-methylindazole-3-carboxamide?
N-[(1R,2R)-2-hydroxycyclohexyl]-1-methylindazole-3-carboxamide has a molecular weight of 273.34 g/mol, XLogP of 1.61, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R,2R)-2-hydroxycyclohexyl]-1-methylindazole-3-carboxamide is sourced from PubChem (CID 103120378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).