[(3S,4S)-4-cyclopropylpyrrolidin-3-yl]methanol

C8H15NO — CID 129408049

IUPAC[(3S,4S)-4-cyclopropylpyrrolidin-3-yl]methanol
SMILESOC[C@@H]1CNC[C@H]1C1CC1
InChIInChI=1S/C8H15NO/c10-5-7-3-9-4-8(7)6-1-2-6/h6-10H,1-5H2/t7-,8-/m0/s1
InChIKeyCJADNGHRHZCOSY-YUMQZZPRSA-N
MW141.21 g/mol
LogP0.22
Rot. Bonds2

About [(3S,4S)-4-cyclopropylpyrrolidin-3-yl]methanol

[(3S,4S)-4-cyclopropylpyrrolidin-3-yl]methanol (PubChem CID 129408049) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is [(3S,4S)-4-cyclopropylpyrrolidin-3-yl]methanol.

Molecular Properties

Compound Name[(3S,4S)-4-cyclopropylpyrrolidin-3-yl]methanol
PubChem CID129408049
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name[(3S,4S)-4-cyclopropylpyrrolidin-3-yl]methanol
SMILESOC[C@@H]1CNC[C@H]1C1CC1
InChIInChI=1S/C8H15NO/c10-5-7-3-9-4-8(7)6-1-2-6/h6-10H,1-5H2/t7-,8-/m0/s1
InChIKeyCJADNGHRHZCOSY-YUMQZZPRSA-N
XLogP0.22
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [(3S,4S)-4-cyclopropylpyrrolidin-3-yl]methanol?
The IUPAC name of [(3S,4S)-4-cyclopropylpyrrolidin-3-yl]methanol (CID 129408049) is [(3S,4S)-4-cyclopropylpyrrolidin-3-yl]methanol.
What is the SMILES notation for [(3S,4S)-4-cyclopropylpyrrolidin-3-yl]methanol?
The canonical SMILES for [(3S,4S)-4-cyclopropylpyrrolidin-3-yl]methanol is OC[C@@H]1CNC[C@H]1C1CC1.
What is the InChIKey of [(3S,4S)-4-cyclopropylpyrrolidin-3-yl]methanol?
The InChIKey is CJADNGHRHZCOSY-YUMQZZPRSA-N. The full InChI is InChI=1S/C8H15NO/c10-5-7-3-9-4-8(7)6-1-2-6/h6-10H,1-5H2/t7-,8-/m0/s1.
What are the key properties of [(3S,4S)-4-cyclopropylpyrrolidin-3-yl]methanol?
[(3S,4S)-4-cyclopropylpyrrolidin-3-yl]methanol has a molecular weight of 141.21 g/mol, XLogP of 0.22, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(3S,4S)-4-cyclopropylpyrrolidin-3-yl]methanol is sourced from PubChem (CID 129408049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).