[2-(3-fluoro-3-methylpyrrolidin-1-yl)cyclopropyl]methanol

C9H16FNO — CID 130918168

IUPAC[2-(3-fluoro-3-methylpyrrolidin-1-yl)cyclopropyl]methanol
SMILESCC1(F)CCN(C2CC2CO)C1
InChIInChI=1S/C9H16FNO/c1-9(10)2-3-11(6-9)8-4-7(8)5-12/h7-8,12H,2-6H2,1H3
InChIKeyGYYPDKMPLZPXFN-UHFFFAOYSA-N
MW173.23 g/mol
LogP0.80
Rot. Bonds2

About [2-(3-fluoro-3-methylpyrrolidin-1-yl)cyclopropyl]methanol

[2-(3-fluoro-3-methylpyrrolidin-1-yl)cyclopropyl]methanol (PubChem CID 130918168) has the molecular formula C9H16FNO and a molecular weight of 173.23 g/mol. Its IUPAC name is [2-(3-fluoro-3-methylpyrrolidin-1-yl)cyclopropyl]methanol.

Molecular Properties

Compound Name[2-(3-fluoro-3-methylpyrrolidin-1-yl)cyclopropyl]methanol
PubChem CID130918168
Molecular FormulaC9H16FNO
Molecular Weight173.23 g/mol
Exact Mass173.12
IUPAC Name[2-(3-fluoro-3-methylpyrrolidin-1-yl)cyclopropyl]methanol
SMILESCC1(F)CCN(C2CC2CO)C1
InChIInChI=1S/C9H16FNO/c1-9(10)2-3-11(6-9)8-4-7(8)5-12/h7-8,12H,2-6H2,1H3
InChIKeyGYYPDKMPLZPXFN-UHFFFAOYSA-N
XLogP0.80
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.23
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1-Isopropylpyrrolidin-3-yl)methanol
CID 16641305
(1-Cyclopropylpyrrolidin-3-yl)methanol
CID 24275425
N-isopentyl-3-hydroxymethylpyrrolidine
CID 10241251
(S)-2-((R)-3-(fluoromethyl)pyrrolidin-1-yl)propan-1-ol
CID 89634400
(1-Tert-butyl-3-fluoropyrrolidin-3-yl)methanol
CID 90155876
[cis-4-Fluoro-1-methyl-pyrrolidin-3-yl]methanol
CID 105530050
((3R,4S)-4-Fluoro-1-methylpyrrolidin-3-yl)methanol
CID 105531136
2-[3-(Fluoromethyl)pyrrolidin-1-yl]propan-1-ol
CID 117774496
[(3R,4R)-1-tert-butyl-4-(trifluoromethyl)pyrrolidin-3-yl]methanol
CID 118418789
(3-Fluoro-1-propan-2-ylpyrrolidin-3-yl)methanol
CID 131018705
[3-Fluoro-1-(2-methylpropyl)pyrrolidin-3-yl]methanol
CID 131089403
((3S,4R)-4-Fluoro-1-methylpyrrolidin-3-yl)methanol
CID 147748171

Frequently Asked Questions

What is the IUPAC name of [2-(3-fluoro-3-methylpyrrolidin-1-yl)cyclopropyl]methanol?
The IUPAC name of [2-(3-fluoro-3-methylpyrrolidin-1-yl)cyclopropyl]methanol (CID 130918168) is [2-(3-fluoro-3-methylpyrrolidin-1-yl)cyclopropyl]methanol.
What is the SMILES notation for [2-(3-fluoro-3-methylpyrrolidin-1-yl)cyclopropyl]methanol?
The canonical SMILES for [2-(3-fluoro-3-methylpyrrolidin-1-yl)cyclopropyl]methanol is CC1(F)CCN(C2CC2CO)C1.
What is the InChIKey of [2-(3-fluoro-3-methylpyrrolidin-1-yl)cyclopropyl]methanol?
The InChIKey is GYYPDKMPLZPXFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16FNO/c1-9(10)2-3-11(6-9)8-4-7(8)5-12/h7-8,12H,2-6H2,1H3.
What are the key properties of [2-(3-fluoro-3-methylpyrrolidin-1-yl)cyclopropyl]methanol?
[2-(3-fluoro-3-methylpyrrolidin-1-yl)cyclopropyl]methanol has a molecular weight of 173.23 g/mol, XLogP of 0.80, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-fluoro-3-methylpyrrolidin-1-yl)cyclopropyl]methanol is sourced from PubChem (CID 130918168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).