3-cyclopropylpyrrolidin-3-ol

C7H13NO — CID 64982945

IUPAC3-cyclopropylpyrrolidin-3-ol
SMILESOC1(C2CC2)CCNC1
InChIInChI=1S/C7H13NO/c9-7(6-1-2-6)3-4-8-5-7/h6,8-9H,1-5H2
InChIKeyVDDGQWSGGBMWQU-UHFFFAOYSA-N
MW127.19 g/mol
LogP0.12
Rot. Bonds1

About 3-cyclopropylpyrrolidin-3-ol

3-cyclopropylpyrrolidin-3-ol (PubChem CID 64982945) has the molecular formula C7H13NO and a molecular weight of 127.19 g/mol. Its IUPAC name is 3-cyclopropylpyrrolidin-3-ol.

Molecular Properties

Compound Name3-cyclopropylpyrrolidin-3-ol
PubChem CID64982945
Molecular FormulaC7H13NO
Molecular Weight127.19 g/mol
Exact Mass127.10
IUPAC Name3-cyclopropylpyrrolidin-3-ol
SMILESOC1(C2CC2)CCNC1
InChIInChI=1S/C7H13NO/c9-7(6-1-2-6)3-4-8-5-7/h6,8-9H,1-5H2
InChIKeyVDDGQWSGGBMWQU-UHFFFAOYSA-N
XLogP0.12
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.19
LogP ≤ 50.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropylpyrrolidin-3-ol?
The IUPAC name of 3-cyclopropylpyrrolidin-3-ol (CID 64982945) is 3-cyclopropylpyrrolidin-3-ol.
What is the SMILES notation for 3-cyclopropylpyrrolidin-3-ol?
The canonical SMILES for 3-cyclopropylpyrrolidin-3-ol is OC1(C2CC2)CCNC1.
What is the InChIKey of 3-cyclopropylpyrrolidin-3-ol?
The InChIKey is VDDGQWSGGBMWQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO/c9-7(6-1-2-6)3-4-8-5-7/h6,8-9H,1-5H2.
What are the key properties of 3-cyclopropylpyrrolidin-3-ol?
3-cyclopropylpyrrolidin-3-ol has a molecular weight of 127.19 g/mol, XLogP of 0.12, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropylpyrrolidin-3-ol is sourced from PubChem (CID 64982945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).