3-(5,6-difluorobenzimidazol-1-yl)propan-1-ol

C10H10F2N2O — CID 110892023

IUPAC3-(5,6-difluorobenzimidazol-1-yl)propan-1-ol
SMILESOCCCn1cnc2cc(F)c(F)cc21
InChIInChI=1S/C10H10F2N2O/c11-7-4-9-10(5-8(7)12)14(6-13-9)2-1-3-15/h4-6,15H,1-3H2
InChIKeyHYWHDYOBWKFDJF-UHFFFAOYSA-N
MW212.20 g/mol
LogP1.70
Rot. Bonds3

About 3-(5,6-difluorobenzimidazol-1-yl)propan-1-ol

3-(5,6-difluorobenzimidazol-1-yl)propan-1-ol (PubChem CID 110892023) has the molecular formula C10H10F2N2O and a molecular weight of 212.20 g/mol. Its IUPAC name is 3-(5,6-difluorobenzimidazol-1-yl)propan-1-ol.

Molecular Properties

Compound Name3-(5,6-difluorobenzimidazol-1-yl)propan-1-ol
PubChem CID110892023
Molecular FormulaC10H10F2N2O
Molecular Weight212.20 g/mol
Exact Mass212.08
IUPAC Name3-(5,6-difluorobenzimidazol-1-yl)propan-1-ol
SMILESOCCCn1cnc2cc(F)c(F)cc21
InChIInChI=1S/C10H10F2N2O/c11-7-4-9-10(5-8(7)12)14(6-13-9)2-1-3-15/h4-6,15H,1-3H2
InChIKeyHYWHDYOBWKFDJF-UHFFFAOYSA-N
XLogP1.70
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.20
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5,6-difluoro-1-pent-4-enylbenzimidazole
CID 115644249
5-(5,6-difluorobenzimidazol-1-yl)pentanehydrazide
CID 63577412
5,6-difluoro-1-(2-methylsulfanylethyl)benzimidazole
CID 115578027
3-(5-aminobenzimidazol-1-yl)propan-1-ol
CID 6504205
5,6-difluoro-1-[3-(4-methoxyphenoxy)propyl]benzimidazole
CID 112812727
N-[4-(5,6-difluorobenzimidazol-1-yl)butyl]cyclopropanamine
CID 62564114
1-(2-bromoprop-2-enyl)-5,6-difluorobenzimidazole
CID 116620789
5,6-difluoro-1-(2-thiophen-2-ylethyl)benzimidazole
CID 113357701
3-(5,6-difluorobenzimidazol-1-yl)-1-phenylpropan-1-one
CID 116691892
5-bromo-1-butyl-6-fluorobenzimidazole;hydrochloride
CID 56737691
4-chloro-N-[2-(5,6-difluorobenzimidazol-1-yl)ethyl]aniline
CID 62564267
5,6-difluoro-1-(2-propan-2-ylsulfonylethyl)benzimidazole
CID 106731638

Frequently Asked Questions

What is the IUPAC name of 3-(5,6-difluorobenzimidazol-1-yl)propan-1-ol?
The IUPAC name of 3-(5,6-difluorobenzimidazol-1-yl)propan-1-ol (CID 110892023) is 3-(5,6-difluorobenzimidazol-1-yl)propan-1-ol.
What is the SMILES notation for 3-(5,6-difluorobenzimidazol-1-yl)propan-1-ol?
The canonical SMILES for 3-(5,6-difluorobenzimidazol-1-yl)propan-1-ol is OCCCn1cnc2cc(F)c(F)cc21.
What is the InChIKey of 3-(5,6-difluorobenzimidazol-1-yl)propan-1-ol?
The InChIKey is HYWHDYOBWKFDJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F2N2O/c11-7-4-9-10(5-8(7)12)14(6-13-9)2-1-3-15/h4-6,15H,1-3H2.
What are the key properties of 3-(5,6-difluorobenzimidazol-1-yl)propan-1-ol?
3-(5,6-difluorobenzimidazol-1-yl)propan-1-ol has a molecular weight of 212.20 g/mol, XLogP of 1.70, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5,6-difluorobenzimidazol-1-yl)propan-1-ol is sourced from PubChem (CID 110892023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).