[2-(ethylamino)-3-fluorophenyl]-(2-propylpiperidin-1-yl)methanone

C17H25FN2O — CID 83046307

IUPAC[2-(ethylamino)-3-fluorophenyl]-(2-propylpiperidin-1-yl)methanone
SMILESCCCC1CCCCN1C(=O)c1cccc(F)c1NCC
InChIInChI=1S/C17H25FN2O/c1-3-8-13-9-5-6-12-20(13)17(21)14-10-7-11-15(18)16(14)19-4-2/h7,10-11,13,19H,3-6,8-9,12H2,1-2H3
InChIKeyOMZAUYLTDCYLHR-UHFFFAOYSA-N
MW292.40 g/mol
LogP4.05
Rot. Bonds5

About [2-(ethylamino)-3-fluorophenyl]-(2-propylpiperidin-1-yl)methanone

[2-(ethylamino)-3-fluorophenyl]-(2-propylpiperidin-1-yl)methanone (PubChem CID 83046307) has the molecular formula C17H25FN2O and a molecular weight of 292.40 g/mol. Its IUPAC name is [2-(ethylamino)-3-fluorophenyl]-(2-propylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name[2-(ethylamino)-3-fluorophenyl]-(2-propylpiperidin-1-yl)methanone
PubChem CID83046307
Molecular FormulaC17H25FN2O
Molecular Weight292.40 g/mol
Exact Mass292.20
IUPAC Name[2-(ethylamino)-3-fluorophenyl]-(2-propylpiperidin-1-yl)methanone
SMILESCCCC1CCCCN1C(=O)c1cccc(F)c1NCC
InChIInChI=1S/C17H25FN2O/c1-3-8-13-9-5-6-12-20(13)17(21)14-10-7-11-15(18)16(14)19-4-2/h7,10-11,13,19H,3-6,8-9,12H2,1-2H3
InChIKeyOMZAUYLTDCYLHR-UHFFFAOYSA-N
XLogP4.05
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.40
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [2-(ethylamino)-3-fluorophenyl]-(2-propylpiperidin-1-yl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[2-(ethylamino)-3-fluorophenyl]-(2-methylpiperidin-1-yl)methanone
CID 62648743
(2-fluoro-6-hydroxyphenyl)-(2-propylpiperidin-1-yl)methanone
CID 104918435
(2-hydroxyphenyl)-(2-propylpiperidin-1-yl)methanone
CID 83056508
[2-(ethylamino)-3-fluorophenyl]-piperidin-1-ylmethanone
CID 62650415
azocan-1-yl-[2-(ethylamino)-3-fluorophenyl]methanone
CID 62650057
[5-chloro-2-(ethylamino)phenyl]-(2-propylpiperidin-1-yl)methanone
CID 83045411
[2-(propylamino)phenyl]-(2-propylpiperidin-1-yl)methanone
CID 83044104
[3-fluoro-2-(methylamino)phenyl]-[2-(3-hydroxypropyl)pyrrolidin-1-yl]methanone
CID 62660396
(2-fluoro-5-sulfanylphenyl)-(2-propylpiperidin-1-yl)methanone
CID 107033947
(2,3-dimethylpiperidin-1-yl)-[3-fluoro-2-(propylamino)phenyl]methanone
CID 62659970
[3-(ethylamino)-4-pyridinyl]-(2-propylpiperidin-1-yl)methanone
CID 105071000
(2,6-dihydroxyphenyl)-(2-propylpiperidin-1-yl)methanone
CID 107689544

Frequently Asked Questions

What is the IUPAC name of [2-(ethylamino)-3-fluorophenyl]-(2-propylpiperidin-1-yl)methanone?
The IUPAC name of [2-(ethylamino)-3-fluorophenyl]-(2-propylpiperidin-1-yl)methanone (CID 83046307) is [2-(ethylamino)-3-fluorophenyl]-(2-propylpiperidin-1-yl)methanone.
What is the SMILES notation for [2-(ethylamino)-3-fluorophenyl]-(2-propylpiperidin-1-yl)methanone?
The canonical SMILES for [2-(ethylamino)-3-fluorophenyl]-(2-propylpiperidin-1-yl)methanone is CCCC1CCCCN1C(=O)c1cccc(F)c1NCC.
What is the InChIKey of [2-(ethylamino)-3-fluorophenyl]-(2-propylpiperidin-1-yl)methanone?
The InChIKey is OMZAUYLTDCYLHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25FN2O/c1-3-8-13-9-5-6-12-20(13)17(21)14-10-7-11-15(18)16(14)19-4-2/h7,10-11,13,19H,3-6,8-9,12H2,1-2H3.
What are the key properties of [2-(ethylamino)-3-fluorophenyl]-(2-propylpiperidin-1-yl)methanone?
[2-(ethylamino)-3-fluorophenyl]-(2-propylpiperidin-1-yl)methanone has a molecular weight of 292.40 g/mol, XLogP of 4.05, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(ethylamino)-3-fluorophenyl]-(2-propylpiperidin-1-yl)methanone is sourced from PubChem (CID 83046307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).