5-ethyl-2-methyl-1-phenyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)imidazole-4-carboxamide

C23H25N3O — CID 143277469

IUPAC5-ethyl-2-methyl-1-phenyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)imidazole-4-carboxamide
SMILESCCc1c(C(=O)NC2CCCc3ccccc32)nc(C)n1-c1ccccc1
InChIInChI=1S/C23H25N3O/c1-3-21-22(24-16(2)26(21)18-12-5-4-6-13-18)23(27)25-20-15-9-11-17-10-7-8-14-19(17)20/h4-8,10,12-14,20H,3,9,11,15H2,1-2H3,(H,25,27)
InChIKeyCOKQHLGPFBJGPG-UHFFFAOYSA-N
MW359.47 g/mol
LogP4.55
Rot. Bonds4

About 5-ethyl-2-methyl-1-phenyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)imidazole-4-carboxamide

5-ethyl-2-methyl-1-phenyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)imidazole-4-carboxamide (PubChem CID 143277469) has the molecular formula C23H25N3O and a molecular weight of 359.47 g/mol. Its IUPAC name is 5-ethyl-2-methyl-1-phenyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)imidazole-4-carboxamide.

Molecular Properties

Compound Name5-ethyl-2-methyl-1-phenyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)imidazole-4-carboxamide
PubChem CID143277469
Molecular FormulaC23H25N3O
Molecular Weight359.47 g/mol
Exact Mass359.20
IUPAC Name5-ethyl-2-methyl-1-phenyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)imidazole-4-carboxamide
SMILESCCc1c(C(=O)NC2CCCc3ccccc32)nc(C)n1-c1ccccc1
InChIInChI=1S/C23H25N3O/c1-3-21-22(24-16(2)26(21)18-12-5-4-6-13-18)23(27)25-20-15-9-11-17-10-7-8-14-19(17)20/h4-8,10,12-14,20H,3,9,11,15H2,1-2H3,(H,25,27)
InChIKeyCOKQHLGPFBJGPG-UHFFFAOYSA-N
XLogP4.55
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.47
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2-methyl-1-phenyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)imidazole-4-carboxamide?
The IUPAC name of 5-ethyl-2-methyl-1-phenyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)imidazole-4-carboxamide (CID 143277469) is 5-ethyl-2-methyl-1-phenyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)imidazole-4-carboxamide.
What is the SMILES notation for 5-ethyl-2-methyl-1-phenyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)imidazole-4-carboxamide?
The canonical SMILES for 5-ethyl-2-methyl-1-phenyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)imidazole-4-carboxamide is CCc1c(C(=O)NC2CCCc3ccccc32)nc(C)n1-c1ccccc1.
What is the InChIKey of 5-ethyl-2-methyl-1-phenyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)imidazole-4-carboxamide?
The InChIKey is COKQHLGPFBJGPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O/c1-3-21-22(24-16(2)26(21)18-12-5-4-6-13-18)23(27)25-20-15-9-11-17-10-7-8-14-19(17)20/h4-8,10,12-14,20H,3,9,11,15H2,1-2H3,(H,25,27).
What are the key properties of 5-ethyl-2-methyl-1-phenyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)imidazole-4-carboxamide?
5-ethyl-2-methyl-1-phenyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)imidazole-4-carboxamide has a molecular weight of 359.47 g/mol, XLogP of 4.55, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-methyl-1-phenyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)imidazole-4-carboxamide is sourced from PubChem (CID 143277469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).