2-cyclopropyl-1-[(3R)-pyrrolidin-3-yl]ethanol

C9H17NO — CID 164654555

IUPAC2-cyclopropyl-1-[(3R)-pyrrolidin-3-yl]ethanol
SMILESOC(CC1CC1)[C@@H]1CCNC1
InChIInChI=1S/C9H17NO/c11-9(5-7-1-2-7)8-3-4-10-6-8/h7-11H,1-6H2/t8-,9?/m1/s1
InChIKeyCNBDFACFNTZSEW-VEDVMXKPSA-N
MW155.24 g/mol
LogP0.76
Rot. Bonds3

About 2-cyclopropyl-1-[(3R)-pyrrolidin-3-yl]ethanol

2-cyclopropyl-1-[(3R)-pyrrolidin-3-yl]ethanol (PubChem CID 164654555) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is 2-cyclopropyl-1-[(3R)-pyrrolidin-3-yl]ethanol.

Molecular Properties

Compound Name2-cyclopropyl-1-[(3R)-pyrrolidin-3-yl]ethanol
PubChem CID164654555
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name2-cyclopropyl-1-[(3R)-pyrrolidin-3-yl]ethanol
SMILESOC(CC1CC1)[C@@H]1CCNC1
InChIInChI=1S/C9H17NO/c11-9(5-7-1-2-7)8-3-4-10-6-8/h7-11H,1-6H2/t8-,9?/m1/s1
InChIKeyCNBDFACFNTZSEW-VEDVMXKPSA-N
XLogP0.76
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(1R)-2-cyclopropyl-1-[(3S)-piperidin-3-yl]ethanol
CID 124570391
2-cyclopropyl-1-piperidin-4-ylethanol
CID 67828644
1-(azetidin-3-yl)-2-cyclopropylethanol
CID 105428286
2-cyclobutyl-1-piperidin-3-ylethanol
CID 105440851
(1R)-1-[(3R)-pyrrolidin-3-yl]ethane-1,2-diol
CID 55287714
1-(azetidin-3-yl)-2-cyclobutylethanol
CID 105430410
3-methyl-1-pyrrolidin-3-ylbutan-1-ol
CID 78158472
2-piperazin-1-yl-1-pyrrolidin-3-ylethanol
CID 115021800
2-amino-4-hydroxy-4-pyrrolidin-3-ylbutanoic acid
CID 105443031
1-cyclobutyl-2-cyclopropylethanol
CID 64986544
2-(furan-2-yl)-1-[(3R)-pyrrolidin-3-yl]ethanol
CID 164662141
1-[(3R)-pyrrolidin-3-yl]-2-thiophen-2-ylethanol
CID 164654563

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-[(3R)-pyrrolidin-3-yl]ethanol?
The IUPAC name of 2-cyclopropyl-1-[(3R)-pyrrolidin-3-yl]ethanol (CID 164654555) is 2-cyclopropyl-1-[(3R)-pyrrolidin-3-yl]ethanol.
What is the SMILES notation for 2-cyclopropyl-1-[(3R)-pyrrolidin-3-yl]ethanol?
The canonical SMILES for 2-cyclopropyl-1-[(3R)-pyrrolidin-3-yl]ethanol is OC(CC1CC1)[C@@H]1CCNC1.
What is the InChIKey of 2-cyclopropyl-1-[(3R)-pyrrolidin-3-yl]ethanol?
The InChIKey is CNBDFACFNTZSEW-VEDVMXKPSA-N. The full InChI is InChI=1S/C9H17NO/c11-9(5-7-1-2-7)8-3-4-10-6-8/h7-11H,1-6H2/t8-,9?/m1/s1.
What are the key properties of 2-cyclopropyl-1-[(3R)-pyrrolidin-3-yl]ethanol?
2-cyclopropyl-1-[(3R)-pyrrolidin-3-yl]ethanol has a molecular weight of 155.24 g/mol, XLogP of 0.76, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-[(3R)-pyrrolidin-3-yl]ethanol is sourced from PubChem (CID 164654555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).