1-(3-fluoropropyl)-3-methylpiperidine

C9H18FN — CID 127497514

IUPAC1-(3-fluoropropyl)-3-methylpiperidine
SMILESCC1CCCN(CCCF)C1
InChIInChI=1S/C9H18FN/c1-9-4-2-6-11(8-9)7-3-5-10/h9H,2-8H2,1H3
InChIKeyPGHUPNGQLFXJBZ-UHFFFAOYSA-N
MW159.25 g/mol
LogP2.08
Rot. Bonds3

About 1-(3-fluoropropyl)-3-methylpiperidine

1-(3-fluoropropyl)-3-methylpiperidine (PubChem CID 127497514) has the molecular formula C9H18FN and a molecular weight of 159.25 g/mol. Its IUPAC name is 1-(3-fluoropropyl)-3-methylpiperidine.

Molecular Properties

Compound Name1-(3-fluoropropyl)-3-methylpiperidine
PubChem CID127497514
Molecular FormulaC9H18FN
Molecular Weight159.25 g/mol
Exact Mass159.14
IUPAC Name1-(3-fluoropropyl)-3-methylpiperidine
SMILESCC1CCCN(CCCF)C1
InChIInChI=1S/C9H18FN/c1-9-4-2-6-11(8-9)7-3-5-10/h9H,2-8H2,1H3
InChIKeyPGHUPNGQLFXJBZ-UHFFFAOYSA-N
XLogP2.08
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.25
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-butyl-3-methylpiperidine;ethane
CID 143349503
3-(3-methylazecan-1-yl)propan-1-amine
CID 10680071
1-(3,3-difluoropropyl)-3-methylpiperidine
CID 176946116
ethane;3-methyl-1-propylpiperidine
CID 156729460
3-methyl-1-propylpiperidine;propane
CID 145147959
3-methyl-1-(3,3,3-trifluoropropyl)piperidine
CID 77147847
[1-(3-fluoropropyl)piperidin-3-yl]methanamine
CID 81107283
1-(3-fluoropropyl)-3-methyl-1,4-diazepane
CID 81113476
N-ethyl-4-(3-methylpiperidin-1-yl)butan-1-amine
CID 62437965
3-(3-methylpiperidin-1-yl)propane-1-sulfonyl chloride
CID 102548987
1-(3-fluoropropyl)piperidine-3-carbaldehyde
CID 81114403
2,2-difluoro-N-[4-[(3S)-3-methylpiperidin-1-yl]butyl]acetamide
CID 100701582

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoropropyl)-3-methylpiperidine?
The IUPAC name of 1-(3-fluoropropyl)-3-methylpiperidine (CID 127497514) is 1-(3-fluoropropyl)-3-methylpiperidine.
What is the SMILES notation for 1-(3-fluoropropyl)-3-methylpiperidine?
The canonical SMILES for 1-(3-fluoropropyl)-3-methylpiperidine is CC1CCCN(CCCF)C1.
What is the InChIKey of 1-(3-fluoropropyl)-3-methylpiperidine?
The InChIKey is PGHUPNGQLFXJBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18FN/c1-9-4-2-6-11(8-9)7-3-5-10/h9H,2-8H2,1H3.
What are the key properties of 1-(3-fluoropropyl)-3-methylpiperidine?
1-(3-fluoropropyl)-3-methylpiperidine has a molecular weight of 159.25 g/mol, XLogP of 2.08, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluoropropyl)-3-methylpiperidine is sourced from PubChem (CID 127497514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).