3-(2-fluoropiperidin-1-yl)propan-1-ol

C8H16FNO — CID 174358832

IUPAC3-(2-fluoropiperidin-1-yl)propan-1-ol
SMILESOCCCN1CCCCC1F
InChIInChI=1S/C8H16FNO/c9-8-4-1-2-5-10(8)6-3-7-11/h8,11H,1-7H2
InChIKeyIRBBGOLBYRVNFQ-UHFFFAOYSA-N
MW161.22 g/mol
LogP1.15
Rot. Bonds3

About 3-(2-fluoropiperidin-1-yl)propan-1-ol

3-(2-fluoropiperidin-1-yl)propan-1-ol (PubChem CID 174358832) has the molecular formula C8H16FNO and a molecular weight of 161.22 g/mol. Its IUPAC name is 3-(2-fluoropiperidin-1-yl)propan-1-ol.

Molecular Properties

Compound Name3-(2-fluoropiperidin-1-yl)propan-1-ol
PubChem CID174358832
Molecular FormulaC8H16FNO
Molecular Weight161.22 g/mol
Exact Mass161.12
IUPAC Name3-(2-fluoropiperidin-1-yl)propan-1-ol
SMILESOCCCN1CCCCC1F
InChIInChI=1S/C8H16FNO/c9-8-4-1-2-5-10(8)6-3-7-11/h8,11H,1-7H2
InChIKeyIRBBGOLBYRVNFQ-UHFFFAOYSA-N
XLogP1.15
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.22
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}

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Related Compounds

3-[2-(fluoromethyl)piperidin-1-yl]propan-1-ol
CID 67281164
3-[2-(hydroxymethyl)piperidin-1-yl]propan-1-ol;hydrobromide
CID 21144774
4-(2-ethylpiperidin-1-yl)butan-1-ol
CID 43509675
6-[2-(2-hydroxyethyl)piperidin-1-yl]hexan-1-ol
CID 103737919
3-[2-(2-fluoroethyl)pyrrolidin-1-yl]propan-1-ol
CID 67281651
2-[1-(3-fluoropropyl)piperidin-2-yl]ethanol
CID 81113088
1-(4-hydroxybutyl)azepane-2-carboxylic acid
CID 64563148
4-[2-(aminomethyl)azepan-1-yl]butan-1-ol
CID 116640497
1-(6-hydroxyhexyl)piperidine-2-carboxylic acid
CID 104540976
3-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)propan-1-ol
CID 65319985
1-[1-(5-hydroxypentyl)piperidin-2-yl]ethanone
CID 63844463
6-[2-[1-(methylamino)ethyl]piperidin-1-yl]hexan-1-ol
CID 107701936

Frequently Asked Questions

What is the IUPAC name of 3-(2-fluoropiperidin-1-yl)propan-1-ol?
The IUPAC name of 3-(2-fluoropiperidin-1-yl)propan-1-ol (CID 174358832) is 3-(2-fluoropiperidin-1-yl)propan-1-ol.
What is the SMILES notation for 3-(2-fluoropiperidin-1-yl)propan-1-ol?
The canonical SMILES for 3-(2-fluoropiperidin-1-yl)propan-1-ol is OCCCN1CCCCC1F.
What is the InChIKey of 3-(2-fluoropiperidin-1-yl)propan-1-ol?
The InChIKey is IRBBGOLBYRVNFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16FNO/c9-8-4-1-2-5-10(8)6-3-7-11/h8,11H,1-7H2.
What are the key properties of 3-(2-fluoropiperidin-1-yl)propan-1-ol?
3-(2-fluoropiperidin-1-yl)propan-1-ol has a molecular weight of 161.22 g/mol, XLogP of 1.15, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluoropiperidin-1-yl)propan-1-ol is sourced from PubChem (CID 174358832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).