1-(1-cyclopropylethyl)-3-fluoro-4-methylpiperidine

C11H20FN — CID 130725804

IUPAC1-(1-cyclopropylethyl)-3-fluoro-4-methylpiperidine
SMILESCC1CCN(C(C)C2CC2)CC1F
InChIInChI=1S/C11H20FN/c1-8-5-6-13(7-11(8)12)9(2)10-3-4-10/h8-11H,3-7H2,1-2H3
InChIKeyBJNMNCCPRPPWGP-UHFFFAOYSA-N
MW185.29 g/mol
LogP2.46
Rot. Bonds2

About 1-(1-cyclopropylethyl)-3-fluoro-4-methylpiperidine

1-(1-cyclopropylethyl)-3-fluoro-4-methylpiperidine (PubChem CID 130725804) has the molecular formula C11H20FN and a molecular weight of 185.29 g/mol. Its IUPAC name is 1-(1-cyclopropylethyl)-3-fluoro-4-methylpiperidine.

Molecular Properties

Compound Name1-(1-cyclopropylethyl)-3-fluoro-4-methylpiperidine
PubChem CID130725804
Molecular FormulaC11H20FN
Molecular Weight185.29 g/mol
Exact Mass185.16
IUPAC Name1-(1-cyclopropylethyl)-3-fluoro-4-methylpiperidine
SMILESCC1CCN(C(C)C2CC2)CC1F
InChIInChI=1S/C11H20FN/c1-8-5-6-13(7-11(8)12)9(2)10-3-4-10/h8-11H,3-7H2,1-2H3
InChIKeyBJNMNCCPRPPWGP-UHFFFAOYSA-N
XLogP2.46
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.29
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(1-cyclopropylethyl)-3-methylpiperazine
CID 64926432
1-(1-cyclopropylethyl)piperidin-3-ol
CID 130668092
1-(3-fluoro-4-methylpiperidin-1-yl)propan-2-ol
CID 130675497
(3R,4R)-3,4-dimethyl-1-propan-2-ylpiperidine
CID 170359650
(3S,4S)-3,4-dimethyl-1-propan-2-ylpiperidine
CID 147690479
1-(1-cyclohexylethyl)-3-fluoroazetidine
CID 130977995
1-(1-cyclopropylethyl)-3,6-dihydro-2H-pyridine
CID 130734768
1-cyclobutyl-3-fluoro-4-methylpiperidine
CID 130674980
2-amino-1-(3-fluoro-4-methylpiperidin-1-yl)propan-1-one;hydrochloride
CID 130635409
[1-(1-cyclopentylethyl)pyrrolidin-3-yl]methanamine
CID 62632841
3-fluoro-4-methylpiperidine-1-carboxylic acid
CID 87324536
5-(1-cyclopropylethyl)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole
CID 66213526

Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclopropylethyl)-3-fluoro-4-methylpiperidine?
The IUPAC name of 1-(1-cyclopropylethyl)-3-fluoro-4-methylpiperidine (CID 130725804) is 1-(1-cyclopropylethyl)-3-fluoro-4-methylpiperidine.
What is the SMILES notation for 1-(1-cyclopropylethyl)-3-fluoro-4-methylpiperidine?
The canonical SMILES for 1-(1-cyclopropylethyl)-3-fluoro-4-methylpiperidine is CC1CCN(C(C)C2CC2)CC1F.
What is the InChIKey of 1-(1-cyclopropylethyl)-3-fluoro-4-methylpiperidine?
The InChIKey is BJNMNCCPRPPWGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20FN/c1-8-5-6-13(7-11(8)12)9(2)10-3-4-10/h8-11H,3-7H2,1-2H3.
What are the key properties of 1-(1-cyclopropylethyl)-3-fluoro-4-methylpiperidine?
1-(1-cyclopropylethyl)-3-fluoro-4-methylpiperidine has a molecular weight of 185.29 g/mol, XLogP of 2.46, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclopropylethyl)-3-fluoro-4-methylpiperidine is sourced from PubChem (CID 130725804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).