2-chloro-4-methyl-1-phenylmethoxyimidazole

C11H11ClN2O — CID 10867903

IUPAC2-chloro-4-methyl-1-phenylmethoxyimidazole
SMILESCc1cn(OCc2ccccc2)c(Cl)n1
InChIInChI=1S/C11H11ClN2O/c1-9-7-14(11(12)13-9)15-8-10-5-3-2-4-6-10/h2-7H,8H2,1H3
InChIKeyFCKZSQIHAXUMDC-UHFFFAOYSA-N
MW222.68 g/mol
LogP2.47
Rot. Bonds3

About 2-chloro-4-methyl-1-phenylmethoxyimidazole

2-chloro-4-methyl-1-phenylmethoxyimidazole (PubChem CID 10867903) has the molecular formula C11H11ClN2O and a molecular weight of 222.68 g/mol. Its IUPAC name is 2-chloro-4-methyl-1-phenylmethoxyimidazole.

Molecular Properties

Compound Name2-chloro-4-methyl-1-phenylmethoxyimidazole
PubChem CID10867903
Molecular FormulaC11H11ClN2O
Molecular Weight222.68 g/mol
Exact Mass222.06
IUPAC Name2-chloro-4-methyl-1-phenylmethoxyimidazole
SMILESCc1cn(OCc2ccccc2)c(Cl)n1
InChIInChI=1S/C11H11ClN2O/c1-9-7-14(11(12)13-9)15-8-10-5-3-2-4-6-10/h2-7H,8H2,1H3
InChIKeyFCKZSQIHAXUMDC-UHFFFAOYSA-N
XLogP2.47
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.68
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(2-chloro-5-methyl-3-phenylmethoxyimidazol-4-yl)methanol
CID 10999557
3-(4-methyl-1-phenylmethoxyimidazol-2-yl)benzonitrile
CID 175957912
7-chloro-2-methyl-6-phenylmethoxyimidazo[1,2-a]pyridine
CID 166925627
4-chloro-1-phenylmethoxypyrazole
CID 91619331
2,5-dichloro-1-phenylmethoxyimidazole-4-carboxylic acid
CID 11833029
4-ethyl-1-phenylmethoxypyrazole
CID 119082094
3-chloro-6-methyl-4-phenylmethoxy-1,2,4-oxadiazine
CID 174888088
bis(1-benzyl-4,5-dimethyl-3-phenylmethoxy-2H-imidazol-2-ide);silver
CID 20806997
1-benzyl-4,5-dimethyl-3-phenylmethoxyimidazol-1-ium
CID 20806995
dichloromethane;phenylmethoxymethylbenzene
CID 174530379
(1-benzyl-4-methylimidazol-2-yl)methanamine
CID 130214981
3,4-diphenyl-1-phenylmethoxypyrrole
CID 141397574

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-methyl-1-phenylmethoxyimidazole?
The IUPAC name of 2-chloro-4-methyl-1-phenylmethoxyimidazole (CID 10867903) is 2-chloro-4-methyl-1-phenylmethoxyimidazole.
What is the SMILES notation for 2-chloro-4-methyl-1-phenylmethoxyimidazole?
The canonical SMILES for 2-chloro-4-methyl-1-phenylmethoxyimidazole is Cc1cn(OCc2ccccc2)c(Cl)n1.
What is the InChIKey of 2-chloro-4-methyl-1-phenylmethoxyimidazole?
The InChIKey is FCKZSQIHAXUMDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11ClN2O/c1-9-7-14(11(12)13-9)15-8-10-5-3-2-4-6-10/h2-7H,8H2,1H3.
What are the key properties of 2-chloro-4-methyl-1-phenylmethoxyimidazole?
2-chloro-4-methyl-1-phenylmethoxyimidazole has a molecular weight of 222.68 g/mol, XLogP of 2.47, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-methyl-1-phenylmethoxyimidazole is sourced from PubChem (CID 10867903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).