2-chloro-5-(2-methoxyethyl)-1,3-benzoxazole

C10H10ClNO2 — CID 62369370

IUPAC2-chloro-5-(2-methoxyethyl)-1,3-benzoxazole
SMILESCOCCc1ccc2oc(Cl)nc2c1
InChIInChI=1S/C10H10ClNO2/c1-13-5-4-7-2-3-9-8(6-7)12-10(11)14-9/h2-3,6H,4-5H2,1H3
InChIKeyOVGPZTRIMIQDSX-UHFFFAOYSA-N
MW211.65 g/mol
LogP2.67
Rot. Bonds3

About 2-chloro-5-(2-methoxyethyl)-1,3-benzoxazole

2-chloro-5-(2-methoxyethyl)-1,3-benzoxazole (PubChem CID 62369370) has the molecular formula C10H10ClNO2 and a molecular weight of 211.65 g/mol. Its IUPAC name is 2-chloro-5-(2-methoxyethyl)-1,3-benzoxazole.

Molecular Properties

Compound Name2-chloro-5-(2-methoxyethyl)-1,3-benzoxazole
PubChem CID62369370
Molecular FormulaC10H10ClNO2
Molecular Weight211.65 g/mol
Exact Mass211.04
IUPAC Name2-chloro-5-(2-methoxyethyl)-1,3-benzoxazole
SMILESCOCCc1ccc2oc(Cl)nc2c1
InChIInChI=1S/C10H10ClNO2/c1-13-5-4-7-2-3-9-8(6-7)12-10(11)14-9/h2-3,6H,4-5H2,1H3
InChIKeyOVGPZTRIMIQDSX-UHFFFAOYSA-N
XLogP2.67
TPSA35.26 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.65
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-chloro-5-(2-methoxyethyl)-1,3-benzoxazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

methyl 2-(2-chloro-1,3-benzoxazol-5-yl)acetate
CID 66912251
2-chloro-N-(2-methoxyethyl)-1,3-benzoxazole-5-carboxamide
CID 100786779
1-(2-chloro-1,3-benzoxazol-5-yl)-2-methoxyethanone
CID 166871952
2-chloro-5-ethylsulfonyl-1,3-benzoxazole
CID 58906316
N-(2-methoxyethyl)-3-(2-methyl-1,3-benzoxazol-5-yl)propanamide
CID 110390561
1-[5-(2-methoxyethyl)-1-benzofuran-2-yl]-2-methylpropan-1-amine
CID 65439652
[2-(methoxymethyl)-1,3-benzoxazol-5-yl]methanamine
CID 82357690
2-chloro-5-(2,4,4-trimethylpentan-2-yl)-1,3-benzoxazole
CID 63488342
2-chloro-5-methyl-1,3-benzoxazole;1,1,1-triiodoethane
CID 123966793
5-propyl-1,3-benzoxazol-2-amine
CID 62548389
1-[5-(2-methoxyethyl)-1-benzofuran-2-yl]-2,2-dimethylpropan-1-ol
CID 65438398
6-(4-chlorophenoxy)-2-[4-(2-methoxyethyl)phenyl]-1,3-benzoxazole
CID 72945603

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-(2-methoxyethyl)-1,3-benzoxazole?
The IUPAC name of 2-chloro-5-(2-methoxyethyl)-1,3-benzoxazole (CID 62369370) is 2-chloro-5-(2-methoxyethyl)-1,3-benzoxazole.
What is the SMILES notation for 2-chloro-5-(2-methoxyethyl)-1,3-benzoxazole?
The canonical SMILES for 2-chloro-5-(2-methoxyethyl)-1,3-benzoxazole is COCCc1ccc2oc(Cl)nc2c1.
What is the InChIKey of 2-chloro-5-(2-methoxyethyl)-1,3-benzoxazole?
The InChIKey is OVGPZTRIMIQDSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClNO2/c1-13-5-4-7-2-3-9-8(6-7)12-10(11)14-9/h2-3,6H,4-5H2,1H3.
What are the key properties of 2-chloro-5-(2-methoxyethyl)-1,3-benzoxazole?
2-chloro-5-(2-methoxyethyl)-1,3-benzoxazole has a molecular weight of 211.65 g/mol, XLogP of 2.67, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-(2-methoxyethyl)-1,3-benzoxazole is sourced from PubChem (CID 62369370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).