[3-fluoro-1-[[(2S)-pyrrolidin-2-yl]methyl]pyrrolidin-3-yl]methanol

C10H19FN2O — CID 130719897

IUPAC[3-fluoro-1-[[(2S)-pyrrolidin-2-yl]methyl]pyrrolidin-3-yl]methanol
SMILESOCC1(F)CCN(C[C@@H]2CCCN2)C1
InChIInChI=1S/C10H19FN2O/c11-10(8-14)3-5-13(7-10)6-9-2-1-4-12-9/h9,12,14H,1-8H2/t9-,10?/m0/s1
InChIKeyMKZAXEWIBVREBP-RGURZIINSA-N
MW202.27 g/mol
LogP0.14
Rot. Bonds3

About [3-fluoro-1-[[(2S)-pyrrolidin-2-yl]methyl]pyrrolidin-3-yl]methanol

[3-fluoro-1-[[(2S)-pyrrolidin-2-yl]methyl]pyrrolidin-3-yl]methanol (PubChem CID 130719897) has the molecular formula C10H19FN2O and a molecular weight of 202.27 g/mol. Its IUPAC name is [3-fluoro-1-[[(2S)-pyrrolidin-2-yl]methyl]pyrrolidin-3-yl]methanol.

Molecular Properties

Compound Name[3-fluoro-1-[[(2S)-pyrrolidin-2-yl]methyl]pyrrolidin-3-yl]methanol
PubChem CID130719897
Molecular FormulaC10H19FN2O
Molecular Weight202.27 g/mol
Exact Mass202.15
IUPAC Name[3-fluoro-1-[[(2S)-pyrrolidin-2-yl]methyl]pyrrolidin-3-yl]methanol
SMILESOCC1(F)CCN(C[C@@H]2CCCN2)C1
InChIInChI=1S/C10H19FN2O/c11-10(8-14)3-5-13(7-10)6-9-2-1-4-12-9/h9,12,14H,1-8H2/t9-,10?/m0/s1
InChIKeyMKZAXEWIBVREBP-RGURZIINSA-N
XLogP0.14
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.27
LogP ≤ 50.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3,3-difluoro-1-(pyrrolidin-2-ylmethyl)piperidine
CID 115023488
[3-fluoro-1-(piperidin-3-ylmethyl)pyrrolidin-3-yl]methanol;hydrochloride
CID 120858328
(3R)-3-amino-1-[[(2S)-pyrrolidin-2-yl]methyl]piperidine-3-carboxylic acid
CID 153347426
[1-(cyclopropylmethyl)-3-fluoropiperidin-3-yl]methanol
CID 130666200
2-(pyrrolidin-2-ylmethyl)-2-azaspiro[3.5]nonane
CID 79677168
ethane;propane;1-(pyrrolidin-2-ylmethyl)pyrrolidine
CID 143192100
1-(pyrrolidin-2-ylmethyl)piperazine
CID 53406264
2,2-dimethyl-4-[[(2S)-pyrrolidin-2-yl]methyl]morpholine
CID 93204728
7,7-dimethyl-4-(pyrrolidin-2-ylmethyl)-1,4-thiazepane
CID 107455301
2-[4-[[(2S)-piperidin-2-yl]methyl]piperazin-1-yl]ethanol
CID 97109268
2,2,6,6-tetramethyl-4-[[(2S)-pyrrolidin-2-yl]methyl]morpholine
CID 102819699
2,2-dimethyl-1-(pyrrolidin-2-ylmethyl)pyrrolidine
CID 63219861

Frequently Asked Questions

What is the IUPAC name of [3-fluoro-1-[[(2S)-pyrrolidin-2-yl]methyl]pyrrolidin-3-yl]methanol?
The IUPAC name of [3-fluoro-1-[[(2S)-pyrrolidin-2-yl]methyl]pyrrolidin-3-yl]methanol (CID 130719897) is [3-fluoro-1-[[(2S)-pyrrolidin-2-yl]methyl]pyrrolidin-3-yl]methanol.
What is the SMILES notation for [3-fluoro-1-[[(2S)-pyrrolidin-2-yl]methyl]pyrrolidin-3-yl]methanol?
The canonical SMILES for [3-fluoro-1-[[(2S)-pyrrolidin-2-yl]methyl]pyrrolidin-3-yl]methanol is OCC1(F)CCN(C[C@@H]2CCCN2)C1.
What is the InChIKey of [3-fluoro-1-[[(2S)-pyrrolidin-2-yl]methyl]pyrrolidin-3-yl]methanol?
The InChIKey is MKZAXEWIBVREBP-RGURZIINSA-N. The full InChI is InChI=1S/C10H19FN2O/c11-10(8-14)3-5-13(7-10)6-9-2-1-4-12-9/h9,12,14H,1-8H2/t9-,10?/m0/s1.
What are the key properties of [3-fluoro-1-[[(2S)-pyrrolidin-2-yl]methyl]pyrrolidin-3-yl]methanol?
[3-fluoro-1-[[(2S)-pyrrolidin-2-yl]methyl]pyrrolidin-3-yl]methanol has a molecular weight of 202.27 g/mol, XLogP of 0.14, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-fluoro-1-[[(2S)-pyrrolidin-2-yl]methyl]pyrrolidin-3-yl]methanol is sourced from PubChem (CID 130719897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).