N-[(1-hydroxy-4-methylcyclohexyl)methyl]-1H-indazole-6-carboxamide

C16H21N3O2 — CID 65119013

IUPACN-[(1-hydroxy-4-methylcyclohexyl)methyl]-1H-indazole-6-carboxamide
SMILESCC1CCC(O)(CNC(=O)c2ccc3cn[nH]c3c2)CC1
InChIInChI=1S/C16H21N3O2/c1-11-4-6-16(21,7-5-11)10-17-15(20)12-2-3-13-9-18-19-14(13)8-12/h2-3,8-9,11,21H,4-7,10H2,1H3,(H,17,20)(H,18,19)
InChIKeyKRQWEAZKBDFGSS-UHFFFAOYSA-N
MW287.36 g/mol
LogP2.23
Rot. Bonds3

About N-[(1-hydroxy-4-methylcyclohexyl)methyl]-1H-indazole-6-carboxamide

N-[(1-hydroxy-4-methylcyclohexyl)methyl]-1H-indazole-6-carboxamide (PubChem CID 65119013) has the molecular formula C16H21N3O2 and a molecular weight of 287.36 g/mol. Its IUPAC name is N-[(1-hydroxy-4-methylcyclohexyl)methyl]-1H-indazole-6-carboxamide.

Molecular Properties

Compound NameN-[(1-hydroxy-4-methylcyclohexyl)methyl]-1H-indazole-6-carboxamide
PubChem CID65119013
Molecular FormulaC16H21N3O2
Molecular Weight287.36 g/mol
Exact Mass287.16
IUPAC NameN-[(1-hydroxy-4-methylcyclohexyl)methyl]-1H-indazole-6-carboxamide
SMILESCC1CCC(O)(CNC(=O)c2ccc3cn[nH]c3c2)CC1
InChIInChI=1S/C16H21N3O2/c1-11-4-6-16(21,7-5-11)10-17-15(20)12-2-3-13-9-18-19-14(13)8-12/h2-3,8-9,11,21H,4-7,10H2,1H3,(H,17,20)(H,18,19)
InChIKeyKRQWEAZKBDFGSS-UHFFFAOYSA-N
XLogP2.23
TPSA78.01 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 52.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2-methylcyclopentyl)methyl]-1H-indazole-6-carboxamide
CID 107420262
N-[(1-propan-2-ylcyclopropyl)methyl]-1H-indazole-6-carboxamide
CID 103743848
N-[(1-ethylcyclobutyl)methyl]-1H-indazole-6-carboxamide
CID 103741467
4-hydroxy-N-[(1-hydroxy-4-methylcyclohexyl)methyl]benzamide
CID 65119060
N-[(1-hydroxy-4-methylcyclohexyl)methyl]-4-methoxybenzamide
CID 65119825
6-bromo-N-[(1-hydroxy-4-methylcyclohexyl)methyl]pyridine-3-carboxamide
CID 66464153
N-[(1-hydroxy-4-methylcyclohexyl)methyl]-1H-pyrazole-5-carboxamide
CID 65119924
2-chloro-N-[(1-hydroxy-4-methylcyclohexyl)methyl]pyridine-4-carboxamide
CID 65118691
N-[(4-hydroxycyclohexyl)methyl]-1H-indazole-6-carboxamide
CID 106121573
N-[(3-hydroxyoxolan-3-yl)methyl]-1H-indazole-5-carboxamide
CID 103848874
N-[(1-hydroxy-4-methylcyclohexyl)methyl]-6-methoxypyridine-3-carboxamide
CID 65120212
N-[1-(aminomethyl)-2-methylcyclohexyl]-1H-indazole-6-carboxamide
CID 115308660

Frequently Asked Questions

What is the IUPAC name of N-[(1-hydroxy-4-methylcyclohexyl)methyl]-1H-indazole-6-carboxamide?
The IUPAC name of N-[(1-hydroxy-4-methylcyclohexyl)methyl]-1H-indazole-6-carboxamide (CID 65119013) is N-[(1-hydroxy-4-methylcyclohexyl)methyl]-1H-indazole-6-carboxamide.
What is the SMILES notation for N-[(1-hydroxy-4-methylcyclohexyl)methyl]-1H-indazole-6-carboxamide?
The canonical SMILES for N-[(1-hydroxy-4-methylcyclohexyl)methyl]-1H-indazole-6-carboxamide is CC1CCC(O)(CNC(=O)c2ccc3cn[nH]c3c2)CC1.
What is the InChIKey of N-[(1-hydroxy-4-methylcyclohexyl)methyl]-1H-indazole-6-carboxamide?
The InChIKey is KRQWEAZKBDFGSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O2/c1-11-4-6-16(21,7-5-11)10-17-15(20)12-2-3-13-9-18-19-14(13)8-12/h2-3,8-9,11,21H,4-7,10H2,1H3,(H,17,20)(H,18,19).
What are the key properties of N-[(1-hydroxy-4-methylcyclohexyl)methyl]-1H-indazole-6-carboxamide?
N-[(1-hydroxy-4-methylcyclohexyl)methyl]-1H-indazole-6-carboxamide has a molecular weight of 287.36 g/mol, XLogP of 2.23, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-hydroxy-4-methylcyclohexyl)methyl]-1H-indazole-6-carboxamide is sourced from PubChem (CID 65119013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).