ethane;5-methoxy-1,3-dihydrobenzimidazol-2-one

C10H14N2O2 — CID 143892741

IUPACethane;5-methoxy-1,3-dihydrobenzimidazol-2-one
SMILESCC.COc1ccc2[nH]c(=O)[nH]c2c1
InChIInChI=1S/C8H8N2O2.C2H6/c1-12-5-2-3-6-7(4-5)10-8(11)9-6;1-2/h2-4H,1H3,(H2,9,10,11);1-2H3
InChIKeyOINOOMRNFBPMEY-UHFFFAOYSA-N
MW194.23 g/mol
LogP1.89
Rot. Bonds1

About ethane;5-methoxy-1,3-dihydrobenzimidazol-2-one

ethane;5-methoxy-1,3-dihydrobenzimidazol-2-one (PubChem CID 143892741) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is ethane;5-methoxy-1,3-dihydrobenzimidazol-2-one.

Molecular Properties

Compound Nameethane;5-methoxy-1,3-dihydrobenzimidazol-2-one
PubChem CID143892741
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Nameethane;5-methoxy-1,3-dihydrobenzimidazol-2-one
SMILESCC.COc1ccc2[nH]c(=O)[nH]c2c1
InChIInChI=1S/C8H8N2O2.C2H6/c1-12-5-2-3-6-7(4-5)10-8(11)9-6;1-2/h2-4H,1H3,(H2,9,10,11);1-2H3
InChIKeyOINOOMRNFBPMEY-UHFFFAOYSA-N
XLogP1.89
TPSA57.88 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

7-methoxy-1H-quinazoline-2,4-dione
CID 19604241
6-methoxy-1H-quinazoline-2,4-dione;hydrochloride
CID 139789837
5-[amino-(2-fluoro-4-methoxyphenyl)methyl]-1,3-dihydrobenzimidazol-2-one
CID 102882549
N-(2,4-dimethoxyphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide
CID 7586552
ethane;5-methyl-1,3-dihydrobenzimidazol-2-one
CID 90978639
(3-methoxyphenyl) 2-oxo-1,3-dihydrobenzimidazole-5-sulfonate
CID 71902122
2-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)oxy]acetic acid
CID 84675808
2-(2,4-dimethoxyphenyl)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide
CID 17457100
4-methoxy-2-methyl-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]benzenesulfonamide
CID 110785308
5-[1-amino-2-(3-methoxyphenyl)ethyl]-1,3-dihydrobenzimidazol-2-one
CID 43186861
5-[3-(3-methoxyphenyl)prop-2-enoyl]-1,3-dihydrobenzimidazol-2-one
CID 154760186
N-[2-(4-methoxyphenyl)ethyl]-2-oxo-1,3-dihydrobenzimidazole-5-carboxamide
CID 110692315

Frequently Asked Questions

What is the IUPAC name of ethane;5-methoxy-1,3-dihydrobenzimidazol-2-one?
The IUPAC name of ethane;5-methoxy-1,3-dihydrobenzimidazol-2-one (CID 143892741) is ethane;5-methoxy-1,3-dihydrobenzimidazol-2-one.
What is the SMILES notation for ethane;5-methoxy-1,3-dihydrobenzimidazol-2-one?
The canonical SMILES for ethane;5-methoxy-1,3-dihydrobenzimidazol-2-one is CC.COc1ccc2[nH]c(=O)[nH]c2c1.
What is the InChIKey of ethane;5-methoxy-1,3-dihydrobenzimidazol-2-one?
The InChIKey is OINOOMRNFBPMEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2O2.C2H6/c1-12-5-2-3-6-7(4-5)10-8(11)9-6;1-2/h2-4H,1H3,(H2,9,10,11);1-2H3.
What are the key properties of ethane;5-methoxy-1,3-dihydrobenzimidazol-2-one?
ethane;5-methoxy-1,3-dihydrobenzimidazol-2-one has a molecular weight of 194.23 g/mol, XLogP of 1.89, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;5-methoxy-1,3-dihydrobenzimidazol-2-one is sourced from PubChem (CID 143892741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).