2-(diethylamino)-2-methyl-1-(1-propylimidazol-2-yl)butan-1-ol

C15H29N3O — CID 79064029

IUPAC2-(diethylamino)-2-methyl-1-(1-propylimidazol-2-yl)butan-1-ol
SMILESCCCn1ccnc1C(O)C(C)(CC)N(CC)CC
InChIInChI=1S/C15H29N3O/c1-6-11-17-12-10-16-14(17)13(19)15(5,7-2)18(8-3)9-4/h10,12-13,19H,6-9,11H2,1-5H3
InChIKeyRKDDTSXCCGGQQK-UHFFFAOYSA-N
MW267.42 g/mol
LogP2.84
Rot. Bonds8

About 2-(diethylamino)-2-methyl-1-(1-propylimidazol-2-yl)butan-1-ol

2-(diethylamino)-2-methyl-1-(1-propylimidazol-2-yl)butan-1-ol (PubChem CID 79064029) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is 2-(diethylamino)-2-methyl-1-(1-propylimidazol-2-yl)butan-1-ol.

Molecular Properties

Compound Name2-(diethylamino)-2-methyl-1-(1-propylimidazol-2-yl)butan-1-ol
PubChem CID79064029
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC Name2-(diethylamino)-2-methyl-1-(1-propylimidazol-2-yl)butan-1-ol
SMILESCCCn1ccnc1C(O)C(C)(CC)N(CC)CC
InChIInChI=1S/C15H29N3O/c1-6-11-17-12-10-16-14(17)13(19)15(5,7-2)18(8-3)9-4/h10,12-13,19H,6-9,11H2,1-5H3
InChIKeyRKDDTSXCCGGQQK-UHFFFAOYSA-N
XLogP2.84
TPSA41.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(diethylamino)-2-methyl-1-(1-propylimidazol-2-yl)propan-1-ol
CID 79053769
2-(dimethylamino)-2-methyl-1-(1-propylimidazol-2-yl)propan-1-ol
CID 79047519
2-(dimethylamino)-1-(1-ethylimidazol-2-yl)-2-methylbutan-1-ol
CID 79063348
2-N,2-N-diethyl-1-N,2-dimethyl-1-(1-propylimidazol-2-yl)propane-1,2-diamine
CID 79055749
2-methyl-2-phenyl-1-(1-propylimidazol-2-yl)propan-1-ol
CID 63975212
3-(diethylamino)-3-ethyl-1-(1-propylimidazol-2-yl)pentan-2-ol
CID 79752739
2,2-dimethyl-1-(1-pentylimidazol-2-yl)propan-1-ol
CID 102490463
1-(1-ethylimidazol-2-yl)-2,2-dimethylbutan-1-ol
CID 115800026
2-ethyl-2-N,2-N-dimethyl-1-(1-propylimidazol-2-yl)butane-1,2-diamine
CID 79061867
(1R)-1-(1-butylimidazol-2-yl)-2,2,2-trifluoroethanol
CID 9267880
(3-tert-butyl-1-methylpyrazol-4-yl)-(1-propylimidazol-2-yl)methanol
CID 83091359
2-(diethylamino)-2-methyl-1-pyrazin-2-ylbutan-1-ol
CID 79064252

Frequently Asked Questions

What is the IUPAC name of 2-(diethylamino)-2-methyl-1-(1-propylimidazol-2-yl)butan-1-ol?
The IUPAC name of 2-(diethylamino)-2-methyl-1-(1-propylimidazol-2-yl)butan-1-ol (CID 79064029) is 2-(diethylamino)-2-methyl-1-(1-propylimidazol-2-yl)butan-1-ol.
What is the SMILES notation for 2-(diethylamino)-2-methyl-1-(1-propylimidazol-2-yl)butan-1-ol?
The canonical SMILES for 2-(diethylamino)-2-methyl-1-(1-propylimidazol-2-yl)butan-1-ol is CCCn1ccnc1C(O)C(C)(CC)N(CC)CC.
What is the InChIKey of 2-(diethylamino)-2-methyl-1-(1-propylimidazol-2-yl)butan-1-ol?
The InChIKey is RKDDTSXCCGGQQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-6-11-17-12-10-16-14(17)13(19)15(5,7-2)18(8-3)9-4/h10,12-13,19H,6-9,11H2,1-5H3.
What are the key properties of 2-(diethylamino)-2-methyl-1-(1-propylimidazol-2-yl)butan-1-ol?
2-(diethylamino)-2-methyl-1-(1-propylimidazol-2-yl)butan-1-ol has a molecular weight of 267.42 g/mol, XLogP of 2.84, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diethylamino)-2-methyl-1-(1-propylimidazol-2-yl)butan-1-ol is sourced from PubChem (CID 79064029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).