N-[6-methoxy-2-(4-methylcyclohexyl)indazol-5-yl]-2-methylpyrimidine-4-carboxamide

C21H25N5O2 — CID 170239920

IUPACN-[6-methoxy-2-(4-methylcyclohexyl)indazol-5-yl]-2-methylpyrimidine-4-carboxamide
SMILESCOc1cc2nn(C3CCC(C)CC3)cc2cc1NC(=O)c1ccnc(C)n1
InChIInChI=1S/C21H25N5O2/c1-13-4-6-16(7-5-13)26-12-15-10-19(20(28-3)11-18(15)25-26)24-21(27)17-8-9-22-14(2)23-17/h8-13,16H,4-7H2,1-3H3,(H,24,27)
InChIKeyZMQOFXNRZXMWFA-UHFFFAOYSA-N
MW379.46 g/mol
LogP4.15
Rot. Bonds4

About N-[6-methoxy-2-(4-methylcyclohexyl)indazol-5-yl]-2-methylpyrimidine-4-carboxamide

N-[6-methoxy-2-(4-methylcyclohexyl)indazol-5-yl]-2-methylpyrimidine-4-carboxamide (PubChem CID 170239920) has the molecular formula C21H25N5O2 and a molecular weight of 379.46 g/mol. Its IUPAC name is N-[6-methoxy-2-(4-methylcyclohexyl)indazol-5-yl]-2-methylpyrimidine-4-carboxamide.

Molecular Properties

Compound NameN-[6-methoxy-2-(4-methylcyclohexyl)indazol-5-yl]-2-methylpyrimidine-4-carboxamide
PubChem CID170239920
Molecular FormulaC21H25N5O2
Molecular Weight379.46 g/mol
Exact Mass379.20
IUPAC NameN-[6-methoxy-2-(4-methylcyclohexyl)indazol-5-yl]-2-methylpyrimidine-4-carboxamide
SMILESCOc1cc2nn(C3CCC(C)CC3)cc2cc1NC(=O)c1ccnc(C)n1
InChIInChI=1S/C21H25N5O2/c1-13-4-6-16(7-5-13)26-12-15-10-19(20(28-3)11-18(15)25-26)24-21(27)17-8-9-22-14(2)23-17/h8-13,16H,4-7H2,1-3H3,(H,24,27)
InChIKeyZMQOFXNRZXMWFA-UHFFFAOYSA-N
XLogP4.15
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.46
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[6-methoxy-2-(4-methylcyclohexyl)indazol-5-yl]pyrimidine-4-carboxamide
CID 155448826
N-[6-methoxy-2-(4-methylcyclohexyl)indazol-5-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide
CID 170240031
3-fluoro-N-[6-methoxy-2-(4-methylcyclohexyl)indazol-5-yl]pyridine-2-carboxamide
CID 170240266
N-[6-methoxy-2-(4-methylcyclohexyl)indazol-5-yl]-4-(trifluoromethyl)benzamide
CID 170240298
N-[2-(4-ethylcyclohexyl)-6-methoxyindazol-5-yl]pyridine-2-carboxamide
CID 155448816
N-[2-(4-formylcyclohexyl)-6-methoxyindazol-5-yl]-6-methylpyridine-2-carboxamide
CID 155438016
5-fluoro-N-[2-[4-(hydroxymethyl)cyclohexyl]-6-methoxyindazol-5-yl]-6-methylpyridine-2-carboxamide
CID 155438184
6-isocyano-N-[6-methoxy-2-(4-propan-2-ylcyclohexyl)indazol-5-yl]pyridine-2-carboxamide
CID 167375733
N-[2-(4-aminocyclohexyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
CID 162721665
N-[6-cyclopropyloxy-2-(4-methylcyclohexyl)indazol-5-yl]-6-(1,1-difluoroethyl)pyridine-2-carboxamide
CID 155448821
N-[6-(2-hydroxypropan-2-yl)-2-(4-methylcyclohexyl)indazol-5-yl]pyridine-2-carboxamide
CID 167156198
3-fluoro-N-[6-methoxy-2-(4-propan-2-ylcyclohexyl)indazol-5-yl]pyridine-2-carboxamide
CID 155448904

Frequently Asked Questions

What is the IUPAC name of N-[6-methoxy-2-(4-methylcyclohexyl)indazol-5-yl]-2-methylpyrimidine-4-carboxamide?
The IUPAC name of N-[6-methoxy-2-(4-methylcyclohexyl)indazol-5-yl]-2-methylpyrimidine-4-carboxamide (CID 170239920) is N-[6-methoxy-2-(4-methylcyclohexyl)indazol-5-yl]-2-methylpyrimidine-4-carboxamide.
What is the SMILES notation for N-[6-methoxy-2-(4-methylcyclohexyl)indazol-5-yl]-2-methylpyrimidine-4-carboxamide?
The canonical SMILES for N-[6-methoxy-2-(4-methylcyclohexyl)indazol-5-yl]-2-methylpyrimidine-4-carboxamide is COc1cc2nn(C3CCC(C)CC3)cc2cc1NC(=O)c1ccnc(C)n1.
What is the InChIKey of N-[6-methoxy-2-(4-methylcyclohexyl)indazol-5-yl]-2-methylpyrimidine-4-carboxamide?
The InChIKey is ZMQOFXNRZXMWFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N5O2/c1-13-4-6-16(7-5-13)26-12-15-10-19(20(28-3)11-18(15)25-26)24-21(27)17-8-9-22-14(2)23-17/h8-13,16H,4-7H2,1-3H3,(H,24,27).
What are the key properties of N-[6-methoxy-2-(4-methylcyclohexyl)indazol-5-yl]-2-methylpyrimidine-4-carboxamide?
N-[6-methoxy-2-(4-methylcyclohexyl)indazol-5-yl]-2-methylpyrimidine-4-carboxamide has a molecular weight of 379.46 g/mol, XLogP of 4.15, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-methoxy-2-(4-methylcyclohexyl)indazol-5-yl]-2-methylpyrimidine-4-carboxamide is sourced from PubChem (CID 170239920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).