ethane;4-fluoro-4-methylpiperidine

C8H18FN — CID 142139578

IUPACethane;4-fluoro-4-methylpiperidine
SMILESCC.CC1(F)CCNCC1
InChIInChI=1S/C6H12FN.C2H6/c1-6(7)2-4-8-5-3-6;1-2/h8H,2-5H2,1H3;1-2H3
InChIKeyVUICQLXLLFYCRL-UHFFFAOYSA-N
MW147.24 g/mol
LogP2.12
Rot. Bonds

About ethane;4-fluoro-4-methylpiperidine

ethane;4-fluoro-4-methylpiperidine (PubChem CID 142139578) has the molecular formula C8H18FN and a molecular weight of 147.24 g/mol. Its IUPAC name is ethane;4-fluoro-4-methylpiperidine.

Molecular Properties

Compound Nameethane;4-fluoro-4-methylpiperidine
PubChem CID142139578
Molecular FormulaC8H18FN
Molecular Weight147.24 g/mol
Exact Mass147.14
IUPAC Nameethane;4-fluoro-4-methylpiperidine
SMILESCC.CC1(F)CCNCC1
InChIInChI=1S/C6H12FN.C2H6/c1-6(7)2-4-8-5-3-6;1-2/h8H,2-5H2,1H3;1-2H3
InChIKeyVUICQLXLLFYCRL-UHFFFAOYSA-N
XLogP2.12
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.24
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4,4-difluoropiperidine;methane
CID 143607085
1-fluoro-1-methylcyclopropane
CID 18684623
N,4-dimethylpiperidin-4-amine;ethane
CID 162525736
2,2-difluoro-1-methyl-6-azaspiro[2.5]octane
CID 121209308
(3S)-3-fluoro-3-methylpiperidine
CID 97009658
(3R)-3-fluoro-3-methylazepane
CID 124708989
2,8-diazaspiro[4.5]decane;ethane
CID 143048064
1,1,2,2-tetrafluoro-6-azaspiro[2.5]octane;hydrochloride
CID 122163593
1,7-diazaspiro[3.5]nonane;ethane
CID 168977317
1-fluoro-1-methylcycloheptane
CID 57055784
6-azaspiro[2.5]octane;ethane;propane
CID 176979994
6,6-dimethyl-1,4-diazocane
CID 139442519

Frequently Asked Questions

What is the IUPAC name of ethane;4-fluoro-4-methylpiperidine?
The IUPAC name of ethane;4-fluoro-4-methylpiperidine (CID 142139578) is ethane;4-fluoro-4-methylpiperidine.
What is the SMILES notation for ethane;4-fluoro-4-methylpiperidine?
The canonical SMILES for ethane;4-fluoro-4-methylpiperidine is CC.CC1(F)CCNCC1.
What is the InChIKey of ethane;4-fluoro-4-methylpiperidine?
The InChIKey is VUICQLXLLFYCRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12FN.C2H6/c1-6(7)2-4-8-5-3-6;1-2/h8H,2-5H2,1H3;1-2H3.
What are the key properties of ethane;4-fluoro-4-methylpiperidine?
ethane;4-fluoro-4-methylpiperidine has a molecular weight of 147.24 g/mol, XLogP of 2.12, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-fluoro-4-methylpiperidine is sourced from PubChem (CID 142139578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).