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

C14H27N3O — CID 79053769

IUPAC2-(diethylamino)-2-methyl-1-(1-propylimidazol-2-yl)propan-1-ol
SMILESCCCn1ccnc1C(O)C(C)(C)N(CC)CC
InChIInChI=1S/C14H27N3O/c1-6-10-16-11-9-15-13(16)12(18)14(4,5)17(7-2)8-3/h9,11-12,18H,6-8,10H2,1-5H3
InChIKeyCXQRJUAMBADEMW-UHFFFAOYSA-N
MW253.39 g/mol
LogP2.45
Rot. Bonds7

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

2-(diethylamino)-2-methyl-1-(1-propylimidazol-2-yl)propan-1-ol (PubChem CID 79053769) has the molecular formula C14H27N3O and a molecular weight of 253.39 g/mol. Its IUPAC name is 2-(diethylamino)-2-methyl-1-(1-propylimidazol-2-yl)propan-1-ol.

Molecular Properties

Compound Name2-(diethylamino)-2-methyl-1-(1-propylimidazol-2-yl)propan-1-ol
PubChem CID79053769
Molecular FormulaC14H27N3O
Molecular Weight253.39 g/mol
Exact Mass253.22
IUPAC Name2-(diethylamino)-2-methyl-1-(1-propylimidazol-2-yl)propan-1-ol
SMILESCCCn1ccnc1C(O)C(C)(C)N(CC)CC
InChIInChI=1S/C14H27N3O/c1-6-10-16-11-9-15-13(16)12(18)14(4,5)17(7-2)8-3/h9,11-12,18H,6-8,10H2,1-5H3
InChIKeyCXQRJUAMBADEMW-UHFFFAOYSA-N
XLogP2.45
TPSA41.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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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)butan-1-ol
CID 79064029
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
2,2-dimethyl-1-(1-pentylimidazol-2-yl)propan-1-ol
CID 102490463
3-(diethylamino)-3-ethyl-1-(1-propylimidazol-2-yl)pentan-2-ol
CID 79752739
(1R)-1-(1-butylimidazol-2-yl)-2,2,2-trifluoroethanol
CID 9267880
1-(1-ethylimidazol-2-yl)-2,2-dimethylbutan-1-ol
CID 115800026
(3-tert-butyl-1-methylpyrazol-4-yl)-(1-propylimidazol-2-yl)methanol
CID 83091359
1-N,2-N,2-N-triethyl-1-(1-ethylimidazol-2-yl)-2-methylpropane-1,2-diamine
CID 79056002
[3,3-dimethyl-1-(1-propylimidazol-2-yl)butyl]hydrazine
CID 105220315
2-ethyl-2-N,2-N-dimethyl-1-(1-propylimidazol-2-yl)butane-1,2-diamine
CID 79061867

Frequently Asked Questions

What is the IUPAC name of 2-(diethylamino)-2-methyl-1-(1-propylimidazol-2-yl)propan-1-ol?
The IUPAC name of 2-(diethylamino)-2-methyl-1-(1-propylimidazol-2-yl)propan-1-ol (CID 79053769) is 2-(diethylamino)-2-methyl-1-(1-propylimidazol-2-yl)propan-1-ol.
What is the SMILES notation for 2-(diethylamino)-2-methyl-1-(1-propylimidazol-2-yl)propan-1-ol?
The canonical SMILES for 2-(diethylamino)-2-methyl-1-(1-propylimidazol-2-yl)propan-1-ol is CCCn1ccnc1C(O)C(C)(C)N(CC)CC.
What is the InChIKey of 2-(diethylamino)-2-methyl-1-(1-propylimidazol-2-yl)propan-1-ol?
The InChIKey is CXQRJUAMBADEMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O/c1-6-10-16-11-9-15-13(16)12(18)14(4,5)17(7-2)8-3/h9,11-12,18H,6-8,10H2,1-5H3.
What are the key properties of 2-(diethylamino)-2-methyl-1-(1-propylimidazol-2-yl)propan-1-ol?
2-(diethylamino)-2-methyl-1-(1-propylimidazol-2-yl)propan-1-ol has a molecular weight of 253.39 g/mol, XLogP of 2.45, 7 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)propan-1-ol is sourced from PubChem (CID 79053769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).