2-methyl-2-phenyl-1-(1-propylimidazol-2-yl)propan-1-ol

C16H22N2O — CID 63975212

IUPAC2-methyl-2-phenyl-1-(1-propylimidazol-2-yl)propan-1-ol
SMILESCCCn1ccnc1C(O)C(C)(C)c1ccccc1
InChIInChI=1S/C16H22N2O/c1-4-11-18-12-10-17-15(18)14(19)16(2,3)13-8-6-5-7-9-13/h5-10,12,14,19H,4,11H2,1-3H3
InChIKeySEHJRPAIUOPDIZ-UHFFFAOYSA-N
MW258.36 g/mol
LogP3.30
Rot. Bonds5

About 2-methyl-2-phenyl-1-(1-propylimidazol-2-yl)propan-1-ol

2-methyl-2-phenyl-1-(1-propylimidazol-2-yl)propan-1-ol (PubChem CID 63975212) has the molecular formula C16H22N2O and a molecular weight of 258.36 g/mol. Its IUPAC name is 2-methyl-2-phenyl-1-(1-propylimidazol-2-yl)propan-1-ol.

Molecular Properties

Compound Name2-methyl-2-phenyl-1-(1-propylimidazol-2-yl)propan-1-ol
PubChem CID63975212
Molecular FormulaC16H22N2O
Molecular Weight258.36 g/mol
Exact Mass258.17
IUPAC Name2-methyl-2-phenyl-1-(1-propylimidazol-2-yl)propan-1-ol
SMILESCCCn1ccnc1C(O)C(C)(C)c1ccccc1
InChIInChI=1S/C16H22N2O/c1-4-11-18-12-10-17-15(18)14(19)16(2,3)13-8-6-5-7-9-13/h5-10,12,14,19H,4,11H2,1-3H3
InChIKeySEHJRPAIUOPDIZ-UHFFFAOYSA-N
XLogP3.30
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(dimethylamino)-2-methyl-1-(1-propylimidazol-2-yl)propan-1-ol
CID 79047519
2-(diethylamino)-2-methyl-1-(1-propylimidazol-2-yl)propan-1-ol
CID 79053769
2-(diethylamino)-2-methyl-1-(1-propylimidazol-2-yl)butan-1-ol
CID 79064029
1-(1-propylimidazol-2-yl)-2-pyridin-2-ylethanol
CID 63977142
2-phenyl-1-(1-propylimidazol-2-yl)propan-2-ol
CID 79744122
2,2-dimethyl-1-(1-pentylimidazol-2-yl)propan-1-ol
CID 102490463
2-phenyl-1-(1-propylimidazol-2-yl)propan-1-amine
CID 114029101
2-(2-methyl-1,2-diphenylnonadecan-3-yl)-1-propylimidazole
CID 69397803
2-methyl-1-(1-methylimidazol-2-yl)-2-phenyl-N-propylpropan-1-amine
CID 63975390
(1R)-1-(1-butylimidazol-2-yl)-2,2,2-trifluoroethanol
CID 9267880
(5-methylfuran-3-yl)-(1-propylimidazol-2-yl)methanol
CID 114822737
1-(1-ethylimidazol-2-yl)-2,2-dimethylbutan-1-ol
CID 115800026

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-phenyl-1-(1-propylimidazol-2-yl)propan-1-ol?
The IUPAC name of 2-methyl-2-phenyl-1-(1-propylimidazol-2-yl)propan-1-ol (CID 63975212) is 2-methyl-2-phenyl-1-(1-propylimidazol-2-yl)propan-1-ol.
What is the SMILES notation for 2-methyl-2-phenyl-1-(1-propylimidazol-2-yl)propan-1-ol?
The canonical SMILES for 2-methyl-2-phenyl-1-(1-propylimidazol-2-yl)propan-1-ol is CCCn1ccnc1C(O)C(C)(C)c1ccccc1.
What is the InChIKey of 2-methyl-2-phenyl-1-(1-propylimidazol-2-yl)propan-1-ol?
The InChIKey is SEHJRPAIUOPDIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O/c1-4-11-18-12-10-17-15(18)14(19)16(2,3)13-8-6-5-7-9-13/h5-10,12,14,19H,4,11H2,1-3H3.
What are the key properties of 2-methyl-2-phenyl-1-(1-propylimidazol-2-yl)propan-1-ol?
2-methyl-2-phenyl-1-(1-propylimidazol-2-yl)propan-1-ol has a molecular weight of 258.36 g/mol, XLogP of 3.30, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-phenyl-1-(1-propylimidazol-2-yl)propan-1-ol is sourced from PubChem (CID 63975212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).