(4-phenyl-1,5-dipropylimidazol-2-yl)methanol

C16H22N2O — CID 11043452

IUPAC(4-phenyl-1,5-dipropylimidazol-2-yl)methanol
SMILESCCCc1c(-c2ccccc2)nc(CO)n1CCC
InChIInChI=1S/C16H22N2O/c1-3-8-14-16(13-9-6-5-7-10-13)17-15(12-19)18(14)11-4-2/h5-7,9-10,19H,3-4,8,11-12H2,1-2H3
InChIKeyPNWGJFBXRLDVNV-UHFFFAOYSA-N
MW258.36 g/mol
LogP3.40
Rot. Bonds6

About (4-phenyl-1,5-dipropylimidazol-2-yl)methanol

(4-phenyl-1,5-dipropylimidazol-2-yl)methanol (PubChem CID 11043452) has the molecular formula C16H22N2O and a molecular weight of 258.36 g/mol. Its IUPAC name is (4-phenyl-1,5-dipropylimidazol-2-yl)methanol.

Molecular Properties

Compound Name(4-phenyl-1,5-dipropylimidazol-2-yl)methanol
PubChem CID11043452
Molecular FormulaC16H22N2O
Molecular Weight258.36 g/mol
Exact Mass258.17
IUPAC Name(4-phenyl-1,5-dipropylimidazol-2-yl)methanol
SMILESCCCc1c(-c2ccccc2)nc(CO)n1CCC
InChIInChI=1S/C16H22N2O/c1-3-8-14-16(13-9-6-5-7-10-13)17-15(12-19)18(14)11-4-2/h5-7,9-10,19H,3-4,8,11-12H2,1-2H3
InChIKeyPNWGJFBXRLDVNV-UHFFFAOYSA-N
XLogP3.40
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4-phenyl-1,5-dipropylimidazol-2-yl)methanol?
The IUPAC name of (4-phenyl-1,5-dipropylimidazol-2-yl)methanol (CID 11043452) is (4-phenyl-1,5-dipropylimidazol-2-yl)methanol.
What is the SMILES notation for (4-phenyl-1,5-dipropylimidazol-2-yl)methanol?
The canonical SMILES for (4-phenyl-1,5-dipropylimidazol-2-yl)methanol is CCCc1c(-c2ccccc2)nc(CO)n1CCC.
What is the InChIKey of (4-phenyl-1,5-dipropylimidazol-2-yl)methanol?
The InChIKey is PNWGJFBXRLDVNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O/c1-3-8-14-16(13-9-6-5-7-10-13)17-15(12-19)18(14)11-4-2/h5-7,9-10,19H,3-4,8,11-12H2,1-2H3.
What are the key properties of (4-phenyl-1,5-dipropylimidazol-2-yl)methanol?
(4-phenyl-1,5-dipropylimidazol-2-yl)methanol has a molecular weight of 258.36 g/mol, XLogP of 3.40, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-phenyl-1,5-dipropylimidazol-2-yl)methanol is sourced from PubChem (CID 11043452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).