(4-fluorophenyl)-[1-(spiro[3.5]nonane-7-carbonyl)piperidin-4-yl]methanone

C22H28FNO2 — CID 154877652

IUPAC(4-fluorophenyl)-[1-(spiro[3.5]nonane-7-carbonyl)piperidin-4-yl]methanone
SMILESO=C(c1ccc(F)cc1)C1CCN(C(=O)C2CCC3(CCC3)CC2)CC1
InChIInChI=1S/C22H28FNO2/c23-19-4-2-16(3-5-19)20(25)17-8-14-24(15-9-17)21(26)18-6-12-22(13-7-18)10-1-11-22/h2-5,17-18H,1,6-15H2
InChIKeyXYXHSBAEQYVZAD-UHFFFAOYSA-N
MW357.47 g/mol
LogP4.61
Rot. Bonds3

About (4-fluorophenyl)-[1-(spiro[3.5]nonane-7-carbonyl)piperidin-4-yl]methanone

(4-fluorophenyl)-[1-(spiro[3.5]nonane-7-carbonyl)piperidin-4-yl]methanone (PubChem CID 154877652) has the molecular formula C22H28FNO2 and a molecular weight of 357.47 g/mol. Its IUPAC name is (4-fluorophenyl)-[1-(spiro[3.5]nonane-7-carbonyl)piperidin-4-yl]methanone.

Molecular Properties

Compound Name(4-fluorophenyl)-[1-(spiro[3.5]nonane-7-carbonyl)piperidin-4-yl]methanone
PubChem CID154877652
Molecular FormulaC22H28FNO2
Molecular Weight357.47 g/mol
Exact Mass357.21
IUPAC Name(4-fluorophenyl)-[1-(spiro[3.5]nonane-7-carbonyl)piperidin-4-yl]methanone
SMILESO=C(c1ccc(F)cc1)C1CCN(C(=O)C2CCC3(CCC3)CC2)CC1
InChIInChI=1S/C22H28FNO2/c23-19-4-2-16(3-5-19)20(25)17-8-14-24(15-9-17)21(26)18-6-12-22(13-7-18)10-1-11-22/h2-5,17-18H,1,6-15H2
InChIKeyXYXHSBAEQYVZAD-UHFFFAOYSA-N
XLogP4.61
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.47
LogP ≤ 54.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze (4-fluorophenyl)-[1-(spiro[3.5]nonane-7-carbonyl)piperidin-4-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

(4-fluorophenyl)-[1-(pyrrolidine-2-carbonyl)piperidin-4-yl]methanone
CID 50852464
cyclohexyl-[(3S)-3-(4-fluorobenzoyl)piperidin-1-yl]methanone
CID 69455656
(4-methylphenyl)-[1-[1-(pyrrolidine-1-carbonyl)piperidine-4-carbonyl]piperidin-4-yl]methanone
CID 55956853
N-cyclohexyl-4-(4-fluorobenzoyl)piperidine-1-carboxamide
CID 3223565
1-[4-[4-(4-fluorobenzoyl)piperazine-1-carbonyl]piperidin-1-yl]prop-2-en-1-one
CID 166405547
carbonic acid;cyclopropyl-(4-fluorophenyl)methanone
CID 70591136
[1-(3-fluorobenzoyl)piperidin-4-yl]-(4-fluorophenyl)methanone
CID 1438163
(4-chlorophenyl)-[1-(piperidine-4-carbonyl)piperidin-4-yl]methanone;(4-chlorophenyl)-piperidin-4-ylmethanone;hydrochloride
CID 160738469
[1-[1-(2,4-difluorobenzoyl)piperidine-4-carbonyl]piperidin-4-yl]-phenylmethanone
CID 38175445
[4-(pyridin-4-ylamino)piperidin-1-yl]-spiro[3.5]nonan-7-ylmethanone
CID 154870417
[(3S)-1-[(3R)-1,1-dioxothiolane-3-carbonyl]piperidin-3-yl]-(4-fluorophenyl)methanone
CID 100619159
2-[4-(4-fluorobenzoyl)piperidin-1-yl]acetonitrile
CID 3020042

Frequently Asked Questions

What is the IUPAC name of (4-fluorophenyl)-[1-(spiro[3.5]nonane-7-carbonyl)piperidin-4-yl]methanone?
The IUPAC name of (4-fluorophenyl)-[1-(spiro[3.5]nonane-7-carbonyl)piperidin-4-yl]methanone (CID 154877652) is (4-fluorophenyl)-[1-(spiro[3.5]nonane-7-carbonyl)piperidin-4-yl]methanone.
What is the SMILES notation for (4-fluorophenyl)-[1-(spiro[3.5]nonane-7-carbonyl)piperidin-4-yl]methanone?
The canonical SMILES for (4-fluorophenyl)-[1-(spiro[3.5]nonane-7-carbonyl)piperidin-4-yl]methanone is O=C(c1ccc(F)cc1)C1CCN(C(=O)C2CCC3(CCC3)CC2)CC1.
What is the InChIKey of (4-fluorophenyl)-[1-(spiro[3.5]nonane-7-carbonyl)piperidin-4-yl]methanone?
The InChIKey is XYXHSBAEQYVZAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28FNO2/c23-19-4-2-16(3-5-19)20(25)17-8-14-24(15-9-17)21(26)18-6-12-22(13-7-18)10-1-11-22/h2-5,17-18H,1,6-15H2.
What are the key properties of (4-fluorophenyl)-[1-(spiro[3.5]nonane-7-carbonyl)piperidin-4-yl]methanone?
(4-fluorophenyl)-[1-(spiro[3.5]nonane-7-carbonyl)piperidin-4-yl]methanone has a molecular weight of 357.47 g/mol, XLogP of 4.61, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluorophenyl)-[1-(spiro[3.5]nonane-7-carbonyl)piperidin-4-yl]methanone is sourced from PubChem (CID 154877652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).