(5-chloro-2-methoxyphenyl)-imidazol-1-ylmethanone

C11H9ClN2O2 — CID 68987646

IUPAC(5-chloro-2-methoxyphenyl)-imidazol-1-ylmethanone
SMILESCOc1ccc(Cl)cc1C(=O)n1ccnc1
InChIInChI=1S/C11H9ClN2O2/c1-16-10-3-2-8(12)6-9(10)11(15)14-5-4-13-7-14/h2-7H,1H3
InChIKeyCWWPHXFFHATZJM-UHFFFAOYSA-N
MW236.66 g/mol
LogP2.23
Rot. Bonds2

About (5-chloro-2-methoxyphenyl)-imidazol-1-ylmethanone

(5-chloro-2-methoxyphenyl)-imidazol-1-ylmethanone (PubChem CID 68987646) has the molecular formula C11H9ClN2O2 and a molecular weight of 236.66 g/mol. Its IUPAC name is (5-chloro-2-methoxyphenyl)-imidazol-1-ylmethanone.

Molecular Properties

Compound Name(5-chloro-2-methoxyphenyl)-imidazol-1-ylmethanone
PubChem CID68987646
Molecular FormulaC11H9ClN2O2
Molecular Weight236.66 g/mol
Exact Mass236.04
IUPAC Name(5-chloro-2-methoxyphenyl)-imidazol-1-ylmethanone
SMILESCOc1ccc(Cl)cc1C(=O)n1ccnc1
InChIInChI=1S/C11H9ClN2O2/c1-16-10-3-2-8(12)6-9(10)11(15)14-5-4-13-7-14/h2-7H,1H3
InChIKeyCWWPHXFFHATZJM-UHFFFAOYSA-N
XLogP2.23
TPSA44.12 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.66
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-chloro-2-methoxyphenyl)imidazole-1-carboxamide
CID 3468883
methyl 4-(5-chloro-2-methoxybenzoyl)piperazine-1-carboxylate
CID 110803250
N-(3-fluoro-4-methoxyphenyl)imidazole-1-carboxamide
CID 81257589
5-chloro-2-methoxybenzoate
CID 6933314
2-bromo-2-chloro-1-(5-chloro-2-methoxyphenyl)ethanone
CID 116863835
(3-chloro-2-methylphenyl)-imidazol-1-ylmethanone
CID 110463733
1-[1-(2-methoxyphenyl)ethenyl]imidazole
CID 3007441
(5-chloro-2-methoxyphenyl)-pyrimidin-4-ylmethanone
CID 63988733
(3-aminoazetidin-1-yl)-(5-chloro-2-methoxyphenyl)methanone
CID 65244224
1-imidazol-1-yl-3-(2-methoxy-4-methylphenoxy)propan-1-one
CID 94273204
N-(2-methoxy-4-methylphenyl)imidazole-1-carboxamide
CID 81257037
5-chloro-N'-(5-chloro-2-methoxybenzoyl)-2-methoxybenzohydrazide
CID 7922079

Frequently Asked Questions

What is the IUPAC name of (5-chloro-2-methoxyphenyl)-imidazol-1-ylmethanone?
The IUPAC name of (5-chloro-2-methoxyphenyl)-imidazol-1-ylmethanone (CID 68987646) is (5-chloro-2-methoxyphenyl)-imidazol-1-ylmethanone.
What is the SMILES notation for (5-chloro-2-methoxyphenyl)-imidazol-1-ylmethanone?
The canonical SMILES for (5-chloro-2-methoxyphenyl)-imidazol-1-ylmethanone is COc1ccc(Cl)cc1C(=O)n1ccnc1.
What is the InChIKey of (5-chloro-2-methoxyphenyl)-imidazol-1-ylmethanone?
The InChIKey is CWWPHXFFHATZJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClN2O2/c1-16-10-3-2-8(12)6-9(10)11(15)14-5-4-13-7-14/h2-7H,1H3.
What are the key properties of (5-chloro-2-methoxyphenyl)-imidazol-1-ylmethanone?
(5-chloro-2-methoxyphenyl)-imidazol-1-ylmethanone has a molecular weight of 236.66 g/mol, XLogP of 2.23, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chloro-2-methoxyphenyl)-imidazol-1-ylmethanone is sourced from PubChem (CID 68987646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).