2-(dimethylamino)-1-(1-ethylimidazol-2-yl)-2-methylbutan-1-ol

C12H23N3O — CID 79063348

IUPAC2-(dimethylamino)-1-(1-ethylimidazol-2-yl)-2-methylbutan-1-ol
SMILESCCn1ccnc1C(O)C(C)(CC)N(C)C
InChIInChI=1S/C12H23N3O/c1-6-12(3,14(4)5)10(16)11-13-8-9-15(11)7-2/h8-10,16H,6-7H2,1-5H3
InChIKeyCUJDTRSDHULECF-UHFFFAOYSA-N
MW225.34 g/mol
LogP1.67
Rot. Bonds5

About 2-(dimethylamino)-1-(1-ethylimidazol-2-yl)-2-methylbutan-1-ol

2-(dimethylamino)-1-(1-ethylimidazol-2-yl)-2-methylbutan-1-ol (PubChem CID 79063348) has the molecular formula C12H23N3O and a molecular weight of 225.34 g/mol. Its IUPAC name is 2-(dimethylamino)-1-(1-ethylimidazol-2-yl)-2-methylbutan-1-ol.

Molecular Properties

Compound Name2-(dimethylamino)-1-(1-ethylimidazol-2-yl)-2-methylbutan-1-ol
PubChem CID79063348
Molecular FormulaC12H23N3O
Molecular Weight225.34 g/mol
Exact Mass225.18
IUPAC Name2-(dimethylamino)-1-(1-ethylimidazol-2-yl)-2-methylbutan-1-ol
SMILESCCn1ccnc1C(O)C(C)(CC)N(C)C
InChIInChI=1S/C12H23N3O/c1-6-12(3,14(4)5)10(16)11-13-8-9-15(11)7-2/h8-10,16H,6-7H2,1-5H3
InChIKeyCUJDTRSDHULECF-UHFFFAOYSA-N
XLogP1.67
TPSA41.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(1-ethylimidazol-2-yl)-2,2-dimethylbutan-1-ol
CID 115800026
2-(diethylamino)-2-methyl-1-(1-propylimidazol-2-yl)butan-1-ol
CID 79064029
2-(dimethylamino)-2-methyl-1-(1-propylimidazol-2-yl)propan-1-ol
CID 79047519
2-(azepan-1-yl)-1-(1-ethylimidazol-2-yl)-2-methylpropan-1-ol
CID 79051803
1-(1-ethylimidazol-2-yl)-3,3-dimethylbutane-1,2-diol
CID 103457324
7-bicyclo[4.1.0]heptanyl-(1-ethylimidazol-2-yl)methanol
CID 115800045
2-(diethylamino)-2-methyl-1-(1-propylimidazol-2-yl)propan-1-ol
CID 79053769
1-hydrazinyl-N,N,2-trimethyl-1-(1-methylimidazol-2-yl)butan-2-amine
CID 105240575
2,2-dimethyl-1-(1-pentylimidazol-2-yl)propan-1-ol
CID 102490463
2-(dimethylamino)-1-(1-ethylimidazol-2-yl)-2-methylbutan-1-one
CID 79052166
(1R)-1-(1-butylimidazol-2-yl)-2,2,2-trifluoroethanol
CID 9267880
2,2-dimethyl-1-(1-methylimidazol-2-yl)butan-1-ol
CID 115799884

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-1-(1-ethylimidazol-2-yl)-2-methylbutan-1-ol?
The IUPAC name of 2-(dimethylamino)-1-(1-ethylimidazol-2-yl)-2-methylbutan-1-ol (CID 79063348) is 2-(dimethylamino)-1-(1-ethylimidazol-2-yl)-2-methylbutan-1-ol.
What is the SMILES notation for 2-(dimethylamino)-1-(1-ethylimidazol-2-yl)-2-methylbutan-1-ol?
The canonical SMILES for 2-(dimethylamino)-1-(1-ethylimidazol-2-yl)-2-methylbutan-1-ol is CCn1ccnc1C(O)C(C)(CC)N(C)C.
What is the InChIKey of 2-(dimethylamino)-1-(1-ethylimidazol-2-yl)-2-methylbutan-1-ol?
The InChIKey is CUJDTRSDHULECF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O/c1-6-12(3,14(4)5)10(16)11-13-8-9-15(11)7-2/h8-10,16H,6-7H2,1-5H3.
What are the key properties of 2-(dimethylamino)-1-(1-ethylimidazol-2-yl)-2-methylbutan-1-ol?
2-(dimethylamino)-1-(1-ethylimidazol-2-yl)-2-methylbutan-1-ol has a molecular weight of 225.34 g/mol, XLogP of 1.67, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-1-(1-ethylimidazol-2-yl)-2-methylbutan-1-ol is sourced from PubChem (CID 79063348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).