[3-(1-ethylimidazol-2-yl)pyrrolidin-2-yl]methanol

C10H17N3O — CID 131165540

IUPAC[3-(1-ethylimidazol-2-yl)pyrrolidin-2-yl]methanol
SMILESCCn1ccnc1C1CCNC1CO
InChIInChI=1S/C10H17N3O/c1-2-13-6-5-12-10(13)8-3-4-11-9(8)7-14/h5-6,8-9,11,14H,2-4,7H2,1H3
InChIKeyVGRDYEGTMCYWMR-UHFFFAOYSA-N
MW195.27 g/mol
LogP0.34
Rot. Bonds3

About [3-(1-ethylimidazol-2-yl)pyrrolidin-2-yl]methanol

[3-(1-ethylimidazol-2-yl)pyrrolidin-2-yl]methanol (PubChem CID 131165540) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is [3-(1-ethylimidazol-2-yl)pyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[3-(1-ethylimidazol-2-yl)pyrrolidin-2-yl]methanol
PubChem CID131165540
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name[3-(1-ethylimidazol-2-yl)pyrrolidin-2-yl]methanol
SMILESCCn1ccnc1C1CCNC1CO
InChIInChI=1S/C10H17N3O/c1-2-13-6-5-12-10(13)8-3-4-11-9(8)7-14/h5-6,8-9,11,14H,2-4,7H2,1H3
InChIKeyVGRDYEGTMCYWMR-UHFFFAOYSA-N
XLogP0.34
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 50.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(1-ethylimidazol-2-yl)-3-methylpiperidine
CID 114502153
4-(1-ethylimidazol-2-yl)-N-methylpiperidine-2-carboxamide
CID 106779170
2-(3-bromo-2-methylcyclopentyl)-1-ethylimidazole
CID 64908834
2-(1-ethylimidazol-2-yl)cycloheptan-1-amine
CID 63968778
1-[2-(1-ethylimidazol-2-yl)cyclohexyl]-N-methylmethanamine
CID 81026716
N-[[2-(1-ethylimidazol-2-yl)cyclobutyl]methyl]-2-methylpropan-2-amine
CID 81021832
N-(1-ethylimidazol-2-yl)azetidine-2-carboxamide
CID 130964367
(3-pyridin-3-ylpyrrolidin-2-yl)methanol
CID 126982382
4-tert-butyl-2-(1-ethylimidazol-2-yl)cyclohexane-1-carboxylic acid
CID 81020914
N-[[2-(1-ethylimidazol-2-yl)cycloheptyl]methyl]propan-2-amine
CID 81025106
[2-(1-ethylimidazol-2-yl)-4,4-dimethylcyclohexyl]methanamine
CID 81012620
[2-(1-ethylimidazol-2-yl)-4-propan-2-ylcyclohexyl]methanamine
CID 81012134

Frequently Asked Questions

What is the IUPAC name of [3-(1-ethylimidazol-2-yl)pyrrolidin-2-yl]methanol?
The IUPAC name of [3-(1-ethylimidazol-2-yl)pyrrolidin-2-yl]methanol (CID 131165540) is [3-(1-ethylimidazol-2-yl)pyrrolidin-2-yl]methanol.
What is the SMILES notation for [3-(1-ethylimidazol-2-yl)pyrrolidin-2-yl]methanol?
The canonical SMILES for [3-(1-ethylimidazol-2-yl)pyrrolidin-2-yl]methanol is CCn1ccnc1C1CCNC1CO.
What is the InChIKey of [3-(1-ethylimidazol-2-yl)pyrrolidin-2-yl]methanol?
The InChIKey is VGRDYEGTMCYWMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-2-13-6-5-12-10(13)8-3-4-11-9(8)7-14/h5-6,8-9,11,14H,2-4,7H2,1H3.
What are the key properties of [3-(1-ethylimidazol-2-yl)pyrrolidin-2-yl]methanol?
[3-(1-ethylimidazol-2-yl)pyrrolidin-2-yl]methanol has a molecular weight of 195.27 g/mol, XLogP of 0.34, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(1-ethylimidazol-2-yl)pyrrolidin-2-yl]methanol is sourced from PubChem (CID 131165540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).