6-(2-fluoropropan-2-yl)-N-[2-[4-(hydroxymethyl)cyclohexyl]-6-methoxyindazol-5-yl]pyridine-2-carboxamide

C24H29FN4O3 — CID 155438263

IUPAC6-(2-fluoropropan-2-yl)-N-[2-[4-(hydroxymethyl)cyclohexyl]-6-methoxyindazol-5-yl]pyridine-2-carboxamide
SMILESCOc1cc2nn(C3CCC(CO)CC3)cc2cc1NC(=O)c1cccc(C(C)(C)F)n1
InChIInChI=1S/C24H29FN4O3/c1-24(2,25)22-6-4-5-18(26-22)23(31)27-20-11-16-13-29(28-19(16)12-21(20)32-3)17-9-7-15(14-30)8-10-17/h4-6,11-13,15,17,30H,7-10,14H2,1-3H3,(H,27,31)
InChIKeyNWVDQUNJFAGYKC-UHFFFAOYSA-N
MW440.52 g/mol
LogP4.62
Rot. Bonds6

About 6-(2-fluoropropan-2-yl)-N-[2-[4-(hydroxymethyl)cyclohexyl]-6-methoxyindazol-5-yl]pyridine-2-carboxamide

6-(2-fluoropropan-2-yl)-N-[2-[4-(hydroxymethyl)cyclohexyl]-6-methoxyindazol-5-yl]pyridine-2-carboxamide (PubChem CID 155438263) has the molecular formula C24H29FN4O3 and a molecular weight of 440.52 g/mol. Its IUPAC name is 6-(2-fluoropropan-2-yl)-N-[2-[4-(hydroxymethyl)cyclohexyl]-6-methoxyindazol-5-yl]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-(2-fluoropropan-2-yl)-N-[2-[4-(hydroxymethyl)cyclohexyl]-6-methoxyindazol-5-yl]pyridine-2-carboxamide
PubChem CID155438263
Molecular FormulaC24H29FN4O3
Molecular Weight440.52 g/mol
Exact Mass440.22
IUPAC Name6-(2-fluoropropan-2-yl)-N-[2-[4-(hydroxymethyl)cyclohexyl]-6-methoxyindazol-5-yl]pyridine-2-carboxamide
SMILESCOc1cc2nn(C3CCC(CO)CC3)cc2cc1NC(=O)c1cccc(C(C)(C)F)n1
InChIInChI=1S/C24H29FN4O3/c1-24(2,25)22-6-4-5-18(26-22)23(31)27-20-11-16-13-29(28-19(16)12-21(20)32-3)17-9-7-15(14-30)8-10-17/h4-6,11-13,15,17,30H,7-10,14H2,1-3H3,(H,27,31)
InChIKeyNWVDQUNJFAGYKC-UHFFFAOYSA-N
XLogP4.62
TPSA89.27 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500440.52
LogP ≤ 54.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 6-(2-fluoropropan-2-yl)-N-[2-[4-(hydroxymethyl)cyclohexyl]-6-methoxyindazol-5-yl]pyridine-2-carboxamide with MolForge

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Related Compounds

N-[2-(4-aminocyclohexyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
CID 162721665
N-[2-[4-[(dimethylamino)methyl]cyclohexyl]-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
CID 163814713
N-(6-methoxy-2-piperidin-4-ylindazol-5-yl)-6-(trifluoromethyl)pyridine-2-carboxamide;hydrochloride
CID 175973046
5-fluoro-N-[2-[4-(hydroxymethyl)cyclohexyl]-6-methoxyindazol-5-yl]-6-methylpyridine-2-carboxamide
CID 155438184
6-(2-hydroxypropan-2-yl)-N-[6-methoxy-2-(oxan-4-yl)indazol-5-yl]pyridine-2-carboxamide
CID 137377513
N-[2-[4-(hydroxymethyl)cyclohexyl]-6-methoxyindazol-5-yl]-4-(trifluoromethyl)-1,3-thiazole-2-carboxamide
CID 155437771
N-[6-(2-methoxyethoxy)-2-piperidin-4-ylindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
CID 163769872
CID 175632841
CID 175632841
methyl 3-[6-methoxy-5-[[6-(trifluoromethyl)pyridine-2-carbonyl]amino]indazol-2-yl]cyclobutane-1-carboxylate
CID 154970408
N-(2-cyclohexyl-6-ethoxyindazol-5-yl)-6-(trifluoromethyl)pyridine-2-carboxamide
CID 155752149
N-[6-cyclopropyloxy-2-(4-methylcyclohexyl)indazol-5-yl]-6-(1,1-difluoroethyl)pyridine-2-carboxamide
CID 155448821
N-[2-(4-ethylcyclohexyl)-6-methoxyindazol-5-yl]pyridine-2-carboxamide
CID 155448816

Frequently Asked Questions

What is the IUPAC name of 6-(2-fluoropropan-2-yl)-N-[2-[4-(hydroxymethyl)cyclohexyl]-6-methoxyindazol-5-yl]pyridine-2-carboxamide?
The IUPAC name of 6-(2-fluoropropan-2-yl)-N-[2-[4-(hydroxymethyl)cyclohexyl]-6-methoxyindazol-5-yl]pyridine-2-carboxamide (CID 155438263) is 6-(2-fluoropropan-2-yl)-N-[2-[4-(hydroxymethyl)cyclohexyl]-6-methoxyindazol-5-yl]pyridine-2-carboxamide.
What is the SMILES notation for 6-(2-fluoropropan-2-yl)-N-[2-[4-(hydroxymethyl)cyclohexyl]-6-methoxyindazol-5-yl]pyridine-2-carboxamide?
The canonical SMILES for 6-(2-fluoropropan-2-yl)-N-[2-[4-(hydroxymethyl)cyclohexyl]-6-methoxyindazol-5-yl]pyridine-2-carboxamide is COc1cc2nn(C3CCC(CO)CC3)cc2cc1NC(=O)c1cccc(C(C)(C)F)n1.
What is the InChIKey of 6-(2-fluoropropan-2-yl)-N-[2-[4-(hydroxymethyl)cyclohexyl]-6-methoxyindazol-5-yl]pyridine-2-carboxamide?
The InChIKey is NWVDQUNJFAGYKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29FN4O3/c1-24(2,25)22-6-4-5-18(26-22)23(31)27-20-11-16-13-29(28-19(16)12-21(20)32-3)17-9-7-15(14-30)8-10-17/h4-6,11-13,15,17,30H,7-10,14H2,1-3H3,(H,27,31).
What are the key properties of 6-(2-fluoropropan-2-yl)-N-[2-[4-(hydroxymethyl)cyclohexyl]-6-methoxyindazol-5-yl]pyridine-2-carboxamide?
6-(2-fluoropropan-2-yl)-N-[2-[4-(hydroxymethyl)cyclohexyl]-6-methoxyindazol-5-yl]pyridine-2-carboxamide has a molecular weight of 440.52 g/mol, XLogP of 4.62, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-fluoropropan-2-yl)-N-[2-[4-(hydroxymethyl)cyclohexyl]-6-methoxyindazol-5-yl]pyridine-2-carboxamide is sourced from PubChem (CID 155438263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).