(1R)-1-[5-chloro-2-[(3-cyclopropylimidazol-4-yl)methoxy]phenyl]ethanol

C15H17ClN2O2 — CID 66154464

IUPAC(1R)-1-[5-chloro-2-[(3-cyclopropylimidazol-4-yl)methoxy]phenyl]ethanol
SMILESC[C@@H](O)c1cc(Cl)ccc1OCc1cncn1C1CC1
InChIInChI=1S/C15H17ClN2O2/c1-10(19)14-6-11(16)2-5-15(14)20-8-13-7-17-9-18(13)12-3-4-12/h2,5-7,9-10,12,19H,3-4,8H2,1H3/t10-/m1/s1
InChIKeyGHAXOAYJPKHHCU-SNVBAGLBSA-N
MW292.77 g/mol
LogP3.50
Rot. Bonds5

About (1R)-1-[5-chloro-2-[(3-cyclopropylimidazol-4-yl)methoxy]phenyl]ethanol

(1R)-1-[5-chloro-2-[(3-cyclopropylimidazol-4-yl)methoxy]phenyl]ethanol (PubChem CID 66154464) has the molecular formula C15H17ClN2O2 and a molecular weight of 292.77 g/mol. Its IUPAC name is (1R)-1-[5-chloro-2-[(3-cyclopropylimidazol-4-yl)methoxy]phenyl]ethanol.

Molecular Properties

Compound Name(1R)-1-[5-chloro-2-[(3-cyclopropylimidazol-4-yl)methoxy]phenyl]ethanol
PubChem CID66154464
Molecular FormulaC15H17ClN2O2
Molecular Weight292.77 g/mol
Exact Mass292.10
IUPAC Name(1R)-1-[5-chloro-2-[(3-cyclopropylimidazol-4-yl)methoxy]phenyl]ethanol
SMILESC[C@@H](O)c1cc(Cl)ccc1OCc1cncn1C1CC1
InChIInChI=1S/C15H17ClN2O2/c1-10(19)14-6-11(16)2-5-15(14)20-8-13-7-17-9-18(13)12-3-4-12/h2,5-7,9-10,12,19H,3-4,8H2,1H3/t10-/m1/s1
InChIKeyGHAXOAYJPKHHCU-SNVBAGLBSA-N
XLogP3.50
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.77
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[4-bromo-2-[(3-cyclopropylimidazol-4-yl)methoxy]phenyl]ethanol
CID 102948213
1-cyclopropyl-5-[(2-fluoro-5-methylphenoxy)methyl]imidazole
CID 66148013
1-[3-[(3-cyclopropylimidazol-4-yl)methoxy]phenyl]ethanol
CID 66154264
1-[2-[(3-cyclopropylimidazol-4-yl)methoxy]phenyl]-N-ethylethanamine
CID 66152900
[4-[(3-cyclopropylimidazol-4-yl)methoxy]-3-methoxyphenyl]methanamine
CID 66153666
(1R)-1-[2-[(3-cyclopropylimidazol-4-yl)methoxy]-4-methoxyphenyl]ethanamine
CID 82000083
1-cyclopropyl-5-[(5-fluoro-2-methylphenoxy)methyl]imidazole
CID 102990484
1-[5-chloro-2-[(2-methyltetrazol-5-yl)methoxy]phenyl]ethanol
CID 107043835
(1S)-1-(5-chloro-2-cyclopropyloxyphenyl)ethanol
CID 130562903
(1S)-1-[5-chloro-2-[(2,4-dichlorophenyl)methoxy]phenyl]ethanol
CID 78944605
N-[[5-bromo-2-[(3-cyclopropylimidazol-4-yl)methoxy]phenyl]methyl]ethanamine
CID 66155021
(1S)-1-[5-chloro-2-[(1-methylimidazol-2-yl)methoxy]phenyl]ethanol
CID 55191286

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[5-chloro-2-[(3-cyclopropylimidazol-4-yl)methoxy]phenyl]ethanol?
The IUPAC name of (1R)-1-[5-chloro-2-[(3-cyclopropylimidazol-4-yl)methoxy]phenyl]ethanol (CID 66154464) is (1R)-1-[5-chloro-2-[(3-cyclopropylimidazol-4-yl)methoxy]phenyl]ethanol.
What is the SMILES notation for (1R)-1-[5-chloro-2-[(3-cyclopropylimidazol-4-yl)methoxy]phenyl]ethanol?
The canonical SMILES for (1R)-1-[5-chloro-2-[(3-cyclopropylimidazol-4-yl)methoxy]phenyl]ethanol is C[C@@H](O)c1cc(Cl)ccc1OCc1cncn1C1CC1.
What is the InChIKey of (1R)-1-[5-chloro-2-[(3-cyclopropylimidazol-4-yl)methoxy]phenyl]ethanol?
The InChIKey is GHAXOAYJPKHHCU-SNVBAGLBSA-N. The full InChI is InChI=1S/C15H17ClN2O2/c1-10(19)14-6-11(16)2-5-15(14)20-8-13-7-17-9-18(13)12-3-4-12/h2,5-7,9-10,12,19H,3-4,8H2,1H3/t10-/m1/s1.
What are the key properties of (1R)-1-[5-chloro-2-[(3-cyclopropylimidazol-4-yl)methoxy]phenyl]ethanol?
(1R)-1-[5-chloro-2-[(3-cyclopropylimidazol-4-yl)methoxy]phenyl]ethanol has a molecular weight of 292.77 g/mol, XLogP of 3.50, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[5-chloro-2-[(3-cyclopropylimidazol-4-yl)methoxy]phenyl]ethanol is sourced from PubChem (CID 66154464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).