[4-chloro-2-(2-propylimidazol-1-yl)phenyl]methanol

C13H15ClN2O — CID 114845946

IUPAC[4-chloro-2-(2-propylimidazol-1-yl)phenyl]methanol
SMILESCCCc1nccn1-c1cc(Cl)ccc1CO
InChIInChI=1S/C13H15ClN2O/c1-2-3-13-15-6-7-16(13)12-8-11(14)5-4-10(12)9-17/h4-8,17H,2-3,9H2,1H3
InChIKeyRRMPDPJJZJPSLU-UHFFFAOYSA-N
MW250.73 g/mol
LogP2.97
Rot. Bonds4

About [4-chloro-2-(2-propylimidazol-1-yl)phenyl]methanol

[4-chloro-2-(2-propylimidazol-1-yl)phenyl]methanol (PubChem CID 114845946) has the molecular formula C13H15ClN2O and a molecular weight of 250.73 g/mol. Its IUPAC name is [4-chloro-2-(2-propylimidazol-1-yl)phenyl]methanol.

Molecular Properties

Compound Name[4-chloro-2-(2-propylimidazol-1-yl)phenyl]methanol
PubChem CID114845946
Molecular FormulaC13H15ClN2O
Molecular Weight250.73 g/mol
Exact Mass250.09
IUPAC Name[4-chloro-2-(2-propylimidazol-1-yl)phenyl]methanol
SMILESCCCc1nccn1-c1cc(Cl)ccc1CO
InChIInChI=1S/C13H15ClN2O/c1-2-3-13-15-6-7-16(13)12-8-11(14)5-4-10(12)9-17/h4-8,17H,2-3,9H2,1H3
InChIKeyRRMPDPJJZJPSLU-UHFFFAOYSA-N
XLogP2.97
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.73
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[4-chloro-2-(2-propylimidazol-1-yl)phenyl]methyl]cyclopropanamine
CID 114854661
(E)-3-[5-chloro-2-(2-propylimidazol-1-yl)phenyl]prop-2-enoic acid
CID 114858791
(4-chloro-2-propylphenyl)methanol
CID 165125586
3-(chloromethyl)-4-(2-propylimidazol-1-yl)pyridine
CID 81234307
1-[2-(bromomethyl)-4-chlorophenyl]-2-ethylimidazole
CID 107085942
N-[[3-chloro-4-(2-propylimidazol-1-yl)phenyl]methyl]-2-methylpropan-2-amine
CID 81145297
1-[4-(bromomethyl)-2-fluorophenyl]-2-propylimidazole
CID 107086160
(4-chloro-2-pyrazol-1-ylphenyl)methanol
CID 114845909
2-[1-(3-chlorophenyl)imidazol-2-yl]ethanamine
CID 82286818
[5-chloro-2-[2-(1-methylimidazol-2-yl)ethoxy]phenyl]methanol
CID 114528338
1-[2-(2-propylimidazol-1-yl)phenyl]propan-1-ol
CID 112679064
N'-hydroxy-5-methyl-2-(2-propylimidazol-1-yl)benzenecarboximidamide
CID 107930079

Frequently Asked Questions

What is the IUPAC name of [4-chloro-2-(2-propylimidazol-1-yl)phenyl]methanol?
The IUPAC name of [4-chloro-2-(2-propylimidazol-1-yl)phenyl]methanol (CID 114845946) is [4-chloro-2-(2-propylimidazol-1-yl)phenyl]methanol.
What is the SMILES notation for [4-chloro-2-(2-propylimidazol-1-yl)phenyl]methanol?
The canonical SMILES for [4-chloro-2-(2-propylimidazol-1-yl)phenyl]methanol is CCCc1nccn1-c1cc(Cl)ccc1CO.
What is the InChIKey of [4-chloro-2-(2-propylimidazol-1-yl)phenyl]methanol?
The InChIKey is RRMPDPJJZJPSLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15ClN2O/c1-2-3-13-15-6-7-16(13)12-8-11(14)5-4-10(12)9-17/h4-8,17H,2-3,9H2,1H3.
What are the key properties of [4-chloro-2-(2-propylimidazol-1-yl)phenyl]methanol?
[4-chloro-2-(2-propylimidazol-1-yl)phenyl]methanol has a molecular weight of 250.73 g/mol, XLogP of 2.97, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-chloro-2-(2-propylimidazol-1-yl)phenyl]methanol is sourced from PubChem (CID 114845946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).