1-ethyl-4-(2-fluoropropan-2-yl)piperidine

C10H20FN — CID 122428509

IUPAC1-ethyl-4-(2-fluoropropan-2-yl)piperidine
SMILESCCN1CCC(C(C)(C)F)CC1
InChIInChI=1S/C10H20FN/c1-4-12-7-5-9(6-8-12)10(2,3)11/h9H,4-8H2,1-3H3
InChIKeyJCYUGXXYUDXJFS-UHFFFAOYSA-N
MW173.28 g/mol
LogP2.47
Rot. Bonds2

About 1-ethyl-4-(2-fluoropropan-2-yl)piperidine

1-ethyl-4-(2-fluoropropan-2-yl)piperidine (PubChem CID 122428509) has the molecular formula C10H20FN and a molecular weight of 173.28 g/mol. Its IUPAC name is 1-ethyl-4-(2-fluoropropan-2-yl)piperidine.

Molecular Properties

Compound Name1-ethyl-4-(2-fluoropropan-2-yl)piperidine
PubChem CID122428509
Molecular FormulaC10H20FN
Molecular Weight173.28 g/mol
Exact Mass173.16
IUPAC Name1-ethyl-4-(2-fluoropropan-2-yl)piperidine
SMILESCCN1CCC(C(C)(C)F)CC1
InChIInChI=1S/C10H20FN/c1-4-12-7-5-9(6-8-12)10(2,3)11/h9H,4-8H2,1-3H3
InChIKeyJCYUGXXYUDXJFS-UHFFFAOYSA-N
XLogP2.47
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.28
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-(1-ethylpiperidin-4-yl)-3,3-difluoropropan-1-amine
CID 105459090
4-tert-butyl-1-(1-ethylpiperidin-4-yl)piperidine
CID 164838588
ethane;1-ethyl-4-methylpiperidine
CID 143737046
1-ethyl-4-(1-ethylpiperidin-4-yl)piperidine;methane
CID 158707588
4-(3,3-dimethylbutyl)-1-ethylpiperidine
CID 58286807
4-tert-butyl-1-(2,2,2-trifluoroethyl)piperidine
CID 59416758
1-(2,2-dimethylpropyl)-4-(trifluoromethyl)piperidine
CID 58877740
O-[2-(1-ethylpyrrolidin-3-yl)propan-2-yl]hydroxylamine
CID 117104637
1,4,7,10,13,16-hexaethyl-1,4,7,10,13,16-hexazacyclooctadecane
CID 66730221
1-ethyl-4-(3-methylazetidin-1-yl)piperidine
CID 174247988
N,N-dimethylethanamine;1-ethyl-4-methylpiperidine
CID 157328296
1,4-diethylpiperidine;ethane
CID 143709904

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-(2-fluoropropan-2-yl)piperidine?
The IUPAC name of 1-ethyl-4-(2-fluoropropan-2-yl)piperidine (CID 122428509) is 1-ethyl-4-(2-fluoropropan-2-yl)piperidine.
What is the SMILES notation for 1-ethyl-4-(2-fluoropropan-2-yl)piperidine?
The canonical SMILES for 1-ethyl-4-(2-fluoropropan-2-yl)piperidine is CCN1CCC(C(C)(C)F)CC1.
What is the InChIKey of 1-ethyl-4-(2-fluoropropan-2-yl)piperidine?
The InChIKey is JCYUGXXYUDXJFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20FN/c1-4-12-7-5-9(6-8-12)10(2,3)11/h9H,4-8H2,1-3H3.
What are the key properties of 1-ethyl-4-(2-fluoropropan-2-yl)piperidine?
1-ethyl-4-(2-fluoropropan-2-yl)piperidine has a molecular weight of 173.28 g/mol, XLogP of 2.47, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-(2-fluoropropan-2-yl)piperidine is sourced from PubChem (CID 122428509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).