(2S,3R)-3-cyclopropyl-2-propan-2-ylpyrrolidin-3-ol

C10H19NO — CID 59273011

IUPAC(2S,3R)-3-cyclopropyl-2-propan-2-ylpyrrolidin-3-ol
SMILESCC(C)[C@@H]1NCC[C@@]1(O)C1CC1
InChIInChI=1S/C10H19NO/c1-7(2)9-10(12,5-6-11-9)8-3-4-8/h7-9,11-12H,3-6H2,1-2H3/t9-,10+/m0/s1
InChIKeyVUQCUOATHJEFTP-VHSXEESVSA-N
MW169.27 g/mol
LogP1.15
Rot. Bonds2

About (2S,3R)-3-cyclopropyl-2-propan-2-ylpyrrolidin-3-ol

(2S,3R)-3-cyclopropyl-2-propan-2-ylpyrrolidin-3-ol (PubChem CID 59273011) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is (2S,3R)-3-cyclopropyl-2-propan-2-ylpyrrolidin-3-ol.

Molecular Properties

Compound Name(2S,3R)-3-cyclopropyl-2-propan-2-ylpyrrolidin-3-ol
PubChem CID59273011
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name(2S,3R)-3-cyclopropyl-2-propan-2-ylpyrrolidin-3-ol
SMILESCC(C)[C@@H]1NCC[C@@]1(O)C1CC1
InChIInChI=1S/C10H19NO/c1-7(2)9-10(12,5-6-11-9)8-3-4-8/h7-9,11-12H,3-6H2,1-2H3/t9-,10+/m0/s1
InChIKeyVUQCUOATHJEFTP-VHSXEESVSA-N
XLogP1.15
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-Cyclopropylpyrrolidin-3-ol
CID 64982945
1-(2-Ethyl-4-fluoropyrrolidin-2-yl)cyclopropan-1-ol
CID 171827118
3-[(2S)-pyrrolidin-2-yl]pentan-3-ol
CID 10534938
(2S,3S)-3-(1-hydroxy-1-methylethyl)-2-methylpyrrolidine
CID 55299039
(2S,3S)-2-methyl-3-propylpyrrolidin-3-ol
CID 59273025
(2S,3R)-3-cyclopropyl-2-ethylpyrrolidin-3-ol
CID 59273036
(2S,3S)-2-isopropyl-3-methylpyrrolidin-3-ol
CID 59273040
(2S,3S)-2,3-diethylpyrrolidin-3-ol
CID 59273053
(2S,3S)-3-ethyl-2-isopropylpyrrolidin-3-ol
CID 59273069
(2S,3S)-2-ethyl-3-methylpyrrolidin-3-ol
CID 59273072
3-(Cyclopropylmethyl)pyrrolidin-3-ol
CID 59505078
3-(2-Methylpropyl)pyrrolidin-3-ol
CID 63586791

Frequently Asked Questions

What is the IUPAC name of (2S,3R)-3-cyclopropyl-2-propan-2-ylpyrrolidin-3-ol?
The IUPAC name of (2S,3R)-3-cyclopropyl-2-propan-2-ylpyrrolidin-3-ol (CID 59273011) is (2S,3R)-3-cyclopropyl-2-propan-2-ylpyrrolidin-3-ol.
What is the SMILES notation for (2S,3R)-3-cyclopropyl-2-propan-2-ylpyrrolidin-3-ol?
The canonical SMILES for (2S,3R)-3-cyclopropyl-2-propan-2-ylpyrrolidin-3-ol is CC(C)[C@@H]1NCC[C@@]1(O)C1CC1.
What is the InChIKey of (2S,3R)-3-cyclopropyl-2-propan-2-ylpyrrolidin-3-ol?
The InChIKey is VUQCUOATHJEFTP-VHSXEESVSA-N. The full InChI is InChI=1S/C10H19NO/c1-7(2)9-10(12,5-6-11-9)8-3-4-8/h7-9,11-12H,3-6H2,1-2H3/t9-,10+/m0/s1.
What are the key properties of (2S,3R)-3-cyclopropyl-2-propan-2-ylpyrrolidin-3-ol?
(2S,3R)-3-cyclopropyl-2-propan-2-ylpyrrolidin-3-ol has a molecular weight of 169.27 g/mol, XLogP of 1.15, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,3R)-3-cyclopropyl-2-propan-2-ylpyrrolidin-3-ol is sourced from PubChem (CID 59273011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).