1-[1-[2-[(4-chlorophenyl)methoxy]phenyl]prop-1-enyl]imidazole

C19H17ClN2O — CID 3007491

IUPAC1-[1-[2-[(4-chlorophenyl)methoxy]phenyl]prop-1-enyl]imidazole
SMILESCC=C(c1ccccc1OCc1ccc(Cl)cc1)n1ccnc1
InChIInChI=1S/C19H17ClN2O/c1-2-18(22-12-11-21-14-22)17-5-3-4-6-19(17)23-13-15-7-9-16(20)10-8-15/h2-12,14H,13H2,1H3
InChIKeyHKMHFDDKYGODMY-UHFFFAOYSA-N
MW324.81 g/mol
LogP5.02
Rot. Bonds5

About 1-[1-[2-[(4-chlorophenyl)methoxy]phenyl]prop-1-enyl]imidazole

1-[1-[2-[(4-chlorophenyl)methoxy]phenyl]prop-1-enyl]imidazole (PubChem CID 3007491) has the molecular formula C19H17ClN2O and a molecular weight of 324.81 g/mol. Its IUPAC name is 1-[1-[2-[(4-chlorophenyl)methoxy]phenyl]prop-1-enyl]imidazole.

Molecular Properties

Compound Name1-[1-[2-[(4-chlorophenyl)methoxy]phenyl]prop-1-enyl]imidazole
PubChem CID3007491
Molecular FormulaC19H17ClN2O
Molecular Weight324.81 g/mol
Exact Mass324.10
IUPAC Name1-[1-[2-[(4-chlorophenyl)methoxy]phenyl]prop-1-enyl]imidazole
SMILESCC=C(c1ccccc1OCc1ccc(Cl)cc1)n1ccnc1
InChIInChI=1S/C19H17ClN2O/c1-2-18(22-12-11-21-14-22)17-5-3-4-6-19(17)23-13-15-7-9-16(20)10-8-15/h2-12,14H,13H2,1H3
InChIKeyHKMHFDDKYGODMY-UHFFFAOYSA-N
XLogP5.02
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500324.81
LogP ≤ 55.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(Z)-1-[2-[(3-chlorophenyl)methoxy]phenyl]prop-1-enyl]imidazole
CID 6479458
1-[1-(2-hexoxyphenyl)prop-1-enyl]imidazole
CID 70426848
1-[(Z)-1-[5-chloro-2-[(2,4-dichlorophenyl)methoxy]phenyl]prop-1-enyl]imidazole
CID 6479456
1-[1-[5-chloro-2-[(2,4-dichlorophenyl)methoxy]phenyl]prop-1-enyl]imidazole
CID 3007496
1-[1-[5-chloro-2-[(4-chlorophenyl)methoxy]phenyl]-2-methylprop-1-enyl]imidazole
CID 3007501
1-[(Z)-1-(5-chloro-2-propoxyphenyl)prop-1-enyl]imidazole
CID 6479461
N-[(E)-[[2-[(4-ethylphenyl)methoxy]phenyl]-imidazol-1-ylmethylidene]amino]-N-methylmethanamine
CID 87389655
1-[1-(2-ethoxyphenyl)-2-phenylsulfanylethenyl]imidazole
CID 67750303
1-[2-[(4-chlorophenyl)methoxy]phenyl]ethanone
CID 2763955
(Z)-1-[2-[(2,4-dichlorophenyl)methoxy]phenyl]-1-imidazol-1-yl-N-methoxymethanimine
CID 22904486
1-[1-[2-[(2,4-dichlorophenyl)methoxy]phenyl]ethenyl]imidazole
CID 3007459
1-[2-methylsulfanyl-1-(2-pentoxyphenyl)ethenyl]imidazole
CID 4459

Frequently Asked Questions

What is the IUPAC name of 1-[1-[2-[(4-chlorophenyl)methoxy]phenyl]prop-1-enyl]imidazole?
The IUPAC name of 1-[1-[2-[(4-chlorophenyl)methoxy]phenyl]prop-1-enyl]imidazole (CID 3007491) is 1-[1-[2-[(4-chlorophenyl)methoxy]phenyl]prop-1-enyl]imidazole.
What is the SMILES notation for 1-[1-[2-[(4-chlorophenyl)methoxy]phenyl]prop-1-enyl]imidazole?
The canonical SMILES for 1-[1-[2-[(4-chlorophenyl)methoxy]phenyl]prop-1-enyl]imidazole is CC=C(c1ccccc1OCc1ccc(Cl)cc1)n1ccnc1.
What is the InChIKey of 1-[1-[2-[(4-chlorophenyl)methoxy]phenyl]prop-1-enyl]imidazole?
The InChIKey is HKMHFDDKYGODMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClN2O/c1-2-18(22-12-11-21-14-22)17-5-3-4-6-19(17)23-13-15-7-9-16(20)10-8-15/h2-12,14H,13H2,1H3.
What are the key properties of 1-[1-[2-[(4-chlorophenyl)methoxy]phenyl]prop-1-enyl]imidazole?
1-[1-[2-[(4-chlorophenyl)methoxy]phenyl]prop-1-enyl]imidazole has a molecular weight of 324.81 g/mol, XLogP of 5.02, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[2-[(4-chlorophenyl)methoxy]phenyl]prop-1-enyl]imidazole is sourced from PubChem (CID 3007491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).