[2-(dimethylamino)-4-phenyl-1H-imidazol-5-yl]-(4-methylphenyl)methanone

C19H19N3O — CID 177434055

IUPAC[2-(dimethylamino)-4-phenyl-1H-imidazol-5-yl]-(4-methylphenyl)methanone
SMILESCc1ccc(C(=O)c2[nH]c(N(C)C)nc2-c2ccccc2)cc1
InChIInChI=1S/C19H19N3O/c1-13-9-11-15(12-10-13)18(23)17-16(14-7-5-4-6-8-14)20-19(21-17)22(2)3/h4-12H,1-3H3,(H,20,21)
InChIKeyQDFYTDKFCJQKPA-UHFFFAOYSA-N
MW305.38 g/mol
LogP3.68
Rot. Bonds4

About [2-(dimethylamino)-4-phenyl-1H-imidazol-5-yl]-(4-methylphenyl)methanone

[2-(dimethylamino)-4-phenyl-1H-imidazol-5-yl]-(4-methylphenyl)methanone (PubChem CID 177434055) has the molecular formula C19H19N3O and a molecular weight of 305.38 g/mol. Its IUPAC name is [2-(dimethylamino)-4-phenyl-1H-imidazol-5-yl]-(4-methylphenyl)methanone.

Molecular Properties

Compound Name[2-(dimethylamino)-4-phenyl-1H-imidazol-5-yl]-(4-methylphenyl)methanone
PubChem CID177434055
Molecular FormulaC19H19N3O
Molecular Weight305.38 g/mol
Exact Mass305.15
IUPAC Name[2-(dimethylamino)-4-phenyl-1H-imidazol-5-yl]-(4-methylphenyl)methanone
SMILESCc1ccc(C(=O)c2[nH]c(N(C)C)nc2-c2ccccc2)cc1
InChIInChI=1S/C19H19N3O/c1-13-9-11-15(12-10-13)18(23)17-16(14-7-5-4-6-8-14)20-19(21-17)22(2)3/h4-12H,1-3H3,(H,20,21)
InChIKeyQDFYTDKFCJQKPA-UHFFFAOYSA-N
XLogP3.68
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-(dimethylamino)-4-phenyl-1H-imidazol-5-yl]-(4-methylphenyl)methanone?
The IUPAC name of [2-(dimethylamino)-4-phenyl-1H-imidazol-5-yl]-(4-methylphenyl)methanone (CID 177434055) is [2-(dimethylamino)-4-phenyl-1H-imidazol-5-yl]-(4-methylphenyl)methanone.
What is the SMILES notation for [2-(dimethylamino)-4-phenyl-1H-imidazol-5-yl]-(4-methylphenyl)methanone?
The canonical SMILES for [2-(dimethylamino)-4-phenyl-1H-imidazol-5-yl]-(4-methylphenyl)methanone is Cc1ccc(C(=O)c2[nH]c(N(C)C)nc2-c2ccccc2)cc1.
What is the InChIKey of [2-(dimethylamino)-4-phenyl-1H-imidazol-5-yl]-(4-methylphenyl)methanone?
The InChIKey is QDFYTDKFCJQKPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O/c1-13-9-11-15(12-10-13)18(23)17-16(14-7-5-4-6-8-14)20-19(21-17)22(2)3/h4-12H,1-3H3,(H,20,21).
What are the key properties of [2-(dimethylamino)-4-phenyl-1H-imidazol-5-yl]-(4-methylphenyl)methanone?
[2-(dimethylamino)-4-phenyl-1H-imidazol-5-yl]-(4-methylphenyl)methanone has a molecular weight of 305.38 g/mol, XLogP of 3.68, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(dimethylamino)-4-phenyl-1H-imidazol-5-yl]-(4-methylphenyl)methanone is sourced from PubChem (CID 177434055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).