2-(2-fluorophenyl)-3-piperidin-1-ylbutan-2-amine

C15H23FN2 — CID 43830514

IUPAC2-(2-fluorophenyl)-3-piperidin-1-ylbutan-2-amine
SMILESCC(N1CCCCC1)C(C)(N)c1ccccc1F
InChIInChI=1S/C15H23FN2/c1-12(18-10-6-3-7-11-18)15(2,17)13-8-4-5-9-14(13)16/h4-5,8-9,12H,3,6-7,10-11,17H2,1-2H3
InChIKeyFYNMGNMSPSSTFQ-UHFFFAOYSA-N
MW250.36 g/mol
LogP2.87
Rot. Bonds3

About 2-(2-fluorophenyl)-3-piperidin-1-ylbutan-2-amine

2-(2-fluorophenyl)-3-piperidin-1-ylbutan-2-amine (PubChem CID 43830514) has the molecular formula C15H23FN2 and a molecular weight of 250.36 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-3-piperidin-1-ylbutan-2-amine.

Molecular Properties

Compound Name2-(2-fluorophenyl)-3-piperidin-1-ylbutan-2-amine
PubChem CID43830514
Molecular FormulaC15H23FN2
Molecular Weight250.36 g/mol
Exact Mass250.18
IUPAC Name2-(2-fluorophenyl)-3-piperidin-1-ylbutan-2-amine
SMILESCC(N1CCCCC1)C(C)(N)c1ccccc1F
InChIInChI=1S/C15H23FN2/c1-12(18-10-6-3-7-11-18)15(2,17)13-8-4-5-9-14(13)16/h4-5,8-9,12H,3,6-7,10-11,17H2,1-2H3
InChIKeyFYNMGNMSPSSTFQ-UHFFFAOYSA-N
XLogP2.87
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.36
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(azepan-1-yl)-3-(2-fluorophenyl)pentan-3-amine
CID 43830525
(2S,3R,4R)-4-amino-1,1-difluoro-4-(2-fluorophenyl)-3-methoxypentan-2-ol
CID 90147182
3-(2-fluorophenyl)-2-methylpentan-3-amine
CID 62501287
2-(2-fluorophenyl)-1-piperidin-1-ylpent-4-en-2-amine
CID 43830706
2-(2-fluorophenyl)-3-N,3-N-dipropylpentane-2,3-diamine
CID 43830567
(2S)-2-amino-2-(2-fluorophenyl)propan-1-ol
CID 90016000
1,2-diphenyl-1-pyrrolidin-1-ylpropan-2-amine
CID 43829706
3-(4-chlorophenyl)-2-piperidin-1-ylpentan-3-amine
CID 43830737
2-(4-chlorophenyl)-3-piperidin-1-ylbutan-2-ol
CID 90871387
ethane;1-fluoro-2-(trifluoromethyl)benzene;2-methylpropane
CID 142299997
1-(2-fluoro-5-methylphenyl)-1-(2-fluorophenyl)ethanamine
CID 62789032
1-[(2S)-3,3-dimethylbutan-2-yl]pyrrolidine
CID 129260340

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-3-piperidin-1-ylbutan-2-amine?
The IUPAC name of 2-(2-fluorophenyl)-3-piperidin-1-ylbutan-2-amine (CID 43830514) is 2-(2-fluorophenyl)-3-piperidin-1-ylbutan-2-amine.
What is the SMILES notation for 2-(2-fluorophenyl)-3-piperidin-1-ylbutan-2-amine?
The canonical SMILES for 2-(2-fluorophenyl)-3-piperidin-1-ylbutan-2-amine is CC(N1CCCCC1)C(C)(N)c1ccccc1F.
What is the InChIKey of 2-(2-fluorophenyl)-3-piperidin-1-ylbutan-2-amine?
The InChIKey is FYNMGNMSPSSTFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23FN2/c1-12(18-10-6-3-7-11-18)15(2,17)13-8-4-5-9-14(13)16/h4-5,8-9,12H,3,6-7,10-11,17H2,1-2H3.
What are the key properties of 2-(2-fluorophenyl)-3-piperidin-1-ylbutan-2-amine?
2-(2-fluorophenyl)-3-piperidin-1-ylbutan-2-amine has a molecular weight of 250.36 g/mol, XLogP of 2.87, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-3-piperidin-1-ylbutan-2-amine is sourced from PubChem (CID 43830514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).