5-(1-cyclopropylpropyl)-2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1H-imidazole

C19H25FN2O — CID 70208467

IUPAC5-(1-cyclopropylpropyl)-2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1H-imidazole
SMILESCCc1nc(-c2cc(F)c(OC)cc2C)c(C(CC)C2CC2)[nH]1
InChIInChI=1S/C19H25FN2O/c1-5-13(12-7-8-12)18-19(22-17(6-2)21-18)14-10-15(20)16(23-4)9-11(14)3/h9-10,12-13H,5-8H2,1-4H3,(H,21,22)
InChIKeyXDMLIFRAVNKLTO-UHFFFAOYSA-N
MW316.42 g/mol
LogP5.00
Rot. Bonds6

About 5-(1-cyclopropylpropyl)-2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1H-imidazole

5-(1-cyclopropylpropyl)-2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1H-imidazole (PubChem CID 70208467) has the molecular formula C19H25FN2O and a molecular weight of 316.42 g/mol. Its IUPAC name is 5-(1-cyclopropylpropyl)-2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1H-imidazole.

Molecular Properties

Compound Name5-(1-cyclopropylpropyl)-2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1H-imidazole
PubChem CID70208467
Molecular FormulaC19H25FN2O
Molecular Weight316.42 g/mol
Exact Mass316.20
IUPAC Name5-(1-cyclopropylpropyl)-2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1H-imidazole
SMILESCCc1nc(-c2cc(F)c(OC)cc2C)c(C(CC)C2CC2)[nH]1
InChIInChI=1S/C19H25FN2O/c1-5-13(12-7-8-12)18-19(22-17(6-2)21-18)14-10-15(20)16(23-4)9-11(14)3/h9-10,12-13H,5-8H2,1-4H3,(H,21,22)
InChIKeyXDMLIFRAVNKLTO-UHFFFAOYSA-N
XLogP5.00
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.42
LogP ≤ 55.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(1-cyclopropyl-2-methylbutyl)-4-(5-fluoro-4-methoxy-2-methylphenyl)-5H-imidazo[4,5-c]pyridazine
CID 154269715
2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1-pentan-3-ylimidazo[4,5-c]pyridine
CID 18001485
4-(5-fluoro-4-methoxy-2-methylphenyl)-2-methoxy-1-pentan-3-ylimidazo[4,5-c]pyridine
CID 18001531
4-(4-methoxy-2,5-dimethylphenyl)-5-methyl-2-propyl-1H-pyrimidin-6-one
CID 136770031
2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1-(1-methoxypentan-3-yl)imidazo[4,5-c]pyridine
CID 18001399
4-(5-fluoro-4-methoxy-2-methylphenyl)-2-methoxy-1-(1-methoxybutan-2-yl)imidazo[4,5-c]pyridine
CID 18001490
5-(5-fluoro-4-methoxy-2-methylphenyl)-4,6-dimethylpyrimidine
CID 90142190
1-(2-bromo-1-cyclopropylethyl)-2-methoxy-4,5-dimethylbenzene
CID 82094018
3-cyclopropyl-3-(4-fluoro-2-methoxy-5-methylphenyl)propanoic acid
CID 117383658
2-[2-bromo-4-(2,5-difluoro-4-methoxyphenyl)-1H-imidazol-5-yl]ethanamine
CID 84609274
N-(1-cyclopropylpropyl)-3-fluoro-4-methoxyaniline
CID 64918809
2-(chloromethyl)-1-(1-cyclopropylethyl)-5-fluoro-6-methoxybenzimidazole
CID 63597568

Frequently Asked Questions

What is the IUPAC name of 5-(1-cyclopropylpropyl)-2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1H-imidazole?
The IUPAC name of 5-(1-cyclopropylpropyl)-2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1H-imidazole (CID 70208467) is 5-(1-cyclopropylpropyl)-2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1H-imidazole.
What is the SMILES notation for 5-(1-cyclopropylpropyl)-2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1H-imidazole?
The canonical SMILES for 5-(1-cyclopropylpropyl)-2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1H-imidazole is CCc1nc(-c2cc(F)c(OC)cc2C)c(C(CC)C2CC2)[nH]1.
What is the InChIKey of 5-(1-cyclopropylpropyl)-2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1H-imidazole?
The InChIKey is XDMLIFRAVNKLTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25FN2O/c1-5-13(12-7-8-12)18-19(22-17(6-2)21-18)14-10-15(20)16(23-4)9-11(14)3/h9-10,12-13H,5-8H2,1-4H3,(H,21,22).
What are the key properties of 5-(1-cyclopropylpropyl)-2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1H-imidazole?
5-(1-cyclopropylpropyl)-2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1H-imidazole has a molecular weight of 316.42 g/mol, XLogP of 5.00, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-cyclopropylpropyl)-2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1H-imidazole is sourced from PubChem (CID 70208467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).