1-cyclopropyl-3-(1-propylimidazol-2-yl)pyrrolidin-3-ol

C13H21N3O — CID 63975841

IUPAC1-cyclopropyl-3-(1-propylimidazol-2-yl)pyrrolidin-3-ol
SMILESCCCn1ccnc1C1(O)CCN(C2CC2)C1
InChIInChI=1S/C13H21N3O/c1-2-7-15-9-6-14-12(15)13(17)5-8-16(10-13)11-3-4-11/h6,9,11,17H,2-5,7-8,10H2,1H3
InChIKeyZPHQHABHMIBSHZ-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.35
Rot. Bonds4

About 1-cyclopropyl-3-(1-propylimidazol-2-yl)pyrrolidin-3-ol

1-cyclopropyl-3-(1-propylimidazol-2-yl)pyrrolidin-3-ol (PubChem CID 63975841) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is 1-cyclopropyl-3-(1-propylimidazol-2-yl)pyrrolidin-3-ol.

Molecular Properties

Compound Name1-cyclopropyl-3-(1-propylimidazol-2-yl)pyrrolidin-3-ol
PubChem CID63975841
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC Name1-cyclopropyl-3-(1-propylimidazol-2-yl)pyrrolidin-3-ol
SMILESCCCn1ccnc1C1(O)CCN(C2CC2)C1
InChIInChI=1S/C13H21N3O/c1-2-7-15-9-6-14-12(15)13(17)5-8-16(10-13)11-3-4-11/h6,9,11,17H,2-5,7-8,10H2,1H3
InChIKeyZPHQHABHMIBSHZ-UHFFFAOYSA-N
XLogP1.35
TPSA41.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 63975629
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CID 64745868
4-(1-propylimidazol-2-yl)oxan-4-ol
CID 63975845
4-(1-ethylimidazol-2-yl)-1-propylazepan-4-ol
CID 65077460
1-cyclopropyl-3-[(1-methylimidazol-2-yl)methyl]pyrrolidin-3-ol
CID 79743850
1-cyclopropyl-3-(1-ethylpyrazol-4-yl)pyrrolidin-3-ol
CID 62975249
1-(1-ethylimidazol-2-yl)-4-propan-2-ylcyclohexan-1-ol
CID 63975652
3-(1-ethylimidazol-2-yl)-8-azabicyclo[3.2.1]octan-3-ol
CID 63975851
4-(1-ethylimidazol-2-yl)piperidin-4-ol
CID 63975654
1-(1-ethylimidazol-2-yl)-2,2-dimethylcyclobutan-1-ol
CID 130554985
1-[(1-propylimidazol-2-yl)methyl]cycloheptan-1-ol
CID 79744670
3-hydroxy-3-(1-propylimidazol-2-yl)-1H-indol-2-one
CID 83035136

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-(1-propylimidazol-2-yl)pyrrolidin-3-ol?
The IUPAC name of 1-cyclopropyl-3-(1-propylimidazol-2-yl)pyrrolidin-3-ol (CID 63975841) is 1-cyclopropyl-3-(1-propylimidazol-2-yl)pyrrolidin-3-ol.
What is the SMILES notation for 1-cyclopropyl-3-(1-propylimidazol-2-yl)pyrrolidin-3-ol?
The canonical SMILES for 1-cyclopropyl-3-(1-propylimidazol-2-yl)pyrrolidin-3-ol is CCCn1ccnc1C1(O)CCN(C2CC2)C1.
What is the InChIKey of 1-cyclopropyl-3-(1-propylimidazol-2-yl)pyrrolidin-3-ol?
The InChIKey is ZPHQHABHMIBSHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-2-7-15-9-6-14-12(15)13(17)5-8-16(10-13)11-3-4-11/h6,9,11,17H,2-5,7-8,10H2,1H3.
What are the key properties of 1-cyclopropyl-3-(1-propylimidazol-2-yl)pyrrolidin-3-ol?
1-cyclopropyl-3-(1-propylimidazol-2-yl)pyrrolidin-3-ol has a molecular weight of 235.33 g/mol, XLogP of 1.35, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-(1-propylimidazol-2-yl)pyrrolidin-3-ol is sourced from PubChem (CID 63975841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).