7-cyclohexyl-N-(4-methoxyphenyl)-5-methylimidazo[5,1-f][1,2,4]triazin-2-amine

C19H23N5O — CID 11302158

IUPAC7-cyclohexyl-N-(4-methoxyphenyl)-5-methylimidazo[5,1-f][1,2,4]triazin-2-amine
SMILESCOc1ccc(Nc2ncc3c(C)nc(C4CCCCC4)n3n2)cc1
InChIInChI=1S/C19H23N5O/c1-13-17-12-20-19(22-15-8-10-16(25-2)11-9-15)23-24(17)18(21-13)14-6-4-3-5-7-14/h8-12,14H,3-7H2,1-2H3,(H,22,23)
InChIKeyMOMLHOXZNCLCHV-UHFFFAOYSA-N
MW337.43 g/mol
LogP4.23
Rot. Bonds4

About 7-cyclohexyl-N-(4-methoxyphenyl)-5-methylimidazo[5,1-f][1,2,4]triazin-2-amine

7-cyclohexyl-N-(4-methoxyphenyl)-5-methylimidazo[5,1-f][1,2,4]triazin-2-amine (PubChem CID 11302158) has the molecular formula C19H23N5O and a molecular weight of 337.43 g/mol. Its IUPAC name is 7-cyclohexyl-N-(4-methoxyphenyl)-5-methylimidazo[5,1-f][1,2,4]triazin-2-amine.

Molecular Properties

Compound Name7-cyclohexyl-N-(4-methoxyphenyl)-5-methylimidazo[5,1-f][1,2,4]triazin-2-amine
PubChem CID11302158
Molecular FormulaC19H23N5O
Molecular Weight337.43 g/mol
Exact Mass337.19
IUPAC Name7-cyclohexyl-N-(4-methoxyphenyl)-5-methylimidazo[5,1-f][1,2,4]triazin-2-amine
SMILESCOc1ccc(Nc2ncc3c(C)nc(C4CCCCC4)n3n2)cc1
InChIInChI=1S/C19H23N5O/c1-13-17-12-20-19(22-15-8-10-16(25-2)11-9-15)23-24(17)18(21-13)14-6-4-3-5-7-14/h8-12,14H,3-7H2,1-2H3,(H,22,23)
InChIKeyMOMLHOXZNCLCHV-UHFFFAOYSA-N
XLogP4.23
TPSA64.34 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.43
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 7-cyclohexyl-N-(4-methoxyphenyl)-5-methylimidazo[5,1-f][1,2,4]triazin-2-amine?
The IUPAC name of 7-cyclohexyl-N-(4-methoxyphenyl)-5-methylimidazo[5,1-f][1,2,4]triazin-2-amine (CID 11302158) is 7-cyclohexyl-N-(4-methoxyphenyl)-5-methylimidazo[5,1-f][1,2,4]triazin-2-amine.
What is the SMILES notation for 7-cyclohexyl-N-(4-methoxyphenyl)-5-methylimidazo[5,1-f][1,2,4]triazin-2-amine?
The canonical SMILES for 7-cyclohexyl-N-(4-methoxyphenyl)-5-methylimidazo[5,1-f][1,2,4]triazin-2-amine is COc1ccc(Nc2ncc3c(C)nc(C4CCCCC4)n3n2)cc1.
What is the InChIKey of 7-cyclohexyl-N-(4-methoxyphenyl)-5-methylimidazo[5,1-f][1,2,4]triazin-2-amine?
The InChIKey is MOMLHOXZNCLCHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O/c1-13-17-12-20-19(22-15-8-10-16(25-2)11-9-15)23-24(17)18(21-13)14-6-4-3-5-7-14/h8-12,14H,3-7H2,1-2H3,(H,22,23).
What are the key properties of 7-cyclohexyl-N-(4-methoxyphenyl)-5-methylimidazo[5,1-f][1,2,4]triazin-2-amine?
7-cyclohexyl-N-(4-methoxyphenyl)-5-methylimidazo[5,1-f][1,2,4]triazin-2-amine has a molecular weight of 337.43 g/mol, XLogP of 4.23, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-cyclohexyl-N-(4-methoxyphenyl)-5-methylimidazo[5,1-f][1,2,4]triazin-2-amine is sourced from PubChem (CID 11302158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).