2-(3-cyclopropylimidazol-4-yl)-2-(propylamino)ethanol

C11H19N3O — CID 66141261

IUPAC2-(3-cyclopropylimidazol-4-yl)-2-(propylamino)ethanol
SMILESCCCNC(CO)c1cncn1C1CC1
InChIInChI=1S/C11H19N3O/c1-2-5-13-10(7-15)11-6-12-8-14(11)9-3-4-9/h6,8-10,13,15H,2-5,7H2,1H3
InChIKeyUKCXRIJLDLFSOD-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.25
Rot. Bonds6

About 2-(3-cyclopropylimidazol-4-yl)-2-(propylamino)ethanol

2-(3-cyclopropylimidazol-4-yl)-2-(propylamino)ethanol (PubChem CID 66141261) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 2-(3-cyclopropylimidazol-4-yl)-2-(propylamino)ethanol.

Molecular Properties

Compound Name2-(3-cyclopropylimidazol-4-yl)-2-(propylamino)ethanol
PubChem CID66141261
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name2-(3-cyclopropylimidazol-4-yl)-2-(propylamino)ethanol
SMILESCCCNC(CO)c1cncn1C1CC1
InChIInChI=1S/C11H19N3O/c1-2-5-13-10(7-15)11-6-12-8-14(11)9-3-4-9/h6,8-10,13,15H,2-5,7H2,1H3
InChIKeyUKCXRIJLDLFSOD-UHFFFAOYSA-N
XLogP1.25
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3-cyclopropylimidazol-4-yl)-N-propylethane-1,2-diamine
CID 66141019
N-(2-cyclobutylethyl)-1-(3-cyclopropylimidazol-4-yl)ethane-1,2-diamine
CID 113478732
tert-butyl N-[1-(3-cyclobutylimidazol-4-yl)-2-hydroxyethyl]carbamate
CID 114705783
1-(3-cyclopropylimidazol-4-yl)-3-methylbutan-1-ol
CID 66141454
ethyl 2-(3-cyclopropylimidazol-4-yl)-2-[2-(dimethylamino)ethylamino]acetate
CID 66140830
1-(3-cyclopropylimidazol-4-yl)-2-ethoxyethanol
CID 79567273
(2R)-2-[(3-cyclopropylimidazol-4-yl)methylamino]butan-1-ol
CID 104868868
4-amino-3-(3-cyclopropylimidazol-4-yl)pentan-1-ol
CID 66140672
3-amino-1-(3-cyclopropylimidazol-4-yl)-2,2-dimethylpropan-1-ol
CID 79126294
2-chloro-2-(3-cyclopropylimidazol-4-yl)-N-ethylacetamide
CID 66161732
2-(3-cyclopropylimidazol-4-yl)-2-[2-(diethylamino)ethylamino]acetonitrile
CID 66140038
2-(3-cyclopropylimidazol-4-yl)-2-(methylamino)acetic acid
CID 66140041

Frequently Asked Questions

What is the IUPAC name of 2-(3-cyclopropylimidazol-4-yl)-2-(propylamino)ethanol?
The IUPAC name of 2-(3-cyclopropylimidazol-4-yl)-2-(propylamino)ethanol (CID 66141261) is 2-(3-cyclopropylimidazol-4-yl)-2-(propylamino)ethanol.
What is the SMILES notation for 2-(3-cyclopropylimidazol-4-yl)-2-(propylamino)ethanol?
The canonical SMILES for 2-(3-cyclopropylimidazol-4-yl)-2-(propylamino)ethanol is CCCNC(CO)c1cncn1C1CC1.
What is the InChIKey of 2-(3-cyclopropylimidazol-4-yl)-2-(propylamino)ethanol?
The InChIKey is UKCXRIJLDLFSOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-2-5-13-10(7-15)11-6-12-8-14(11)9-3-4-9/h6,8-10,13,15H,2-5,7H2,1H3.
What are the key properties of 2-(3-cyclopropylimidazol-4-yl)-2-(propylamino)ethanol?
2-(3-cyclopropylimidazol-4-yl)-2-(propylamino)ethanol has a molecular weight of 209.29 g/mol, XLogP of 1.25, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-cyclopropylimidazol-4-yl)-2-(propylamino)ethanol is sourced from PubChem (CID 66141261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).