(3-ethylphenyl)-(4-phenylpiperidin-1-yl)methanone

C20H23NO — CID 90124178

IUPAC(3-ethylphenyl)-(4-phenylpiperidin-1-yl)methanone
SMILESCCc1cccc(C(=O)N2CCC(c3ccccc3)CC2)c1
InChIInChI=1S/C20H23NO/c1-2-16-7-6-10-19(15-16)20(22)21-13-11-18(12-14-21)17-8-4-3-5-9-17/h3-10,15,18H,2,11-14H2,1H3
InChIKeyMAIVEOHAYLCMSM-UHFFFAOYSA-N
MW293.41 g/mol
LogP4.27
Rot. Bonds3

About (3-ethylphenyl)-(4-phenylpiperidin-1-yl)methanone

(3-ethylphenyl)-(4-phenylpiperidin-1-yl)methanone (PubChem CID 90124178) has the molecular formula C20H23NO and a molecular weight of 293.41 g/mol. Its IUPAC name is (3-ethylphenyl)-(4-phenylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name(3-ethylphenyl)-(4-phenylpiperidin-1-yl)methanone
PubChem CID90124178
Molecular FormulaC20H23NO
Molecular Weight293.41 g/mol
Exact Mass293.18
IUPAC Name(3-ethylphenyl)-(4-phenylpiperidin-1-yl)methanone
SMILESCCc1cccc(C(=O)N2CCC(c3ccccc3)CC2)c1
InChIInChI=1S/C20H23NO/c1-2-16-7-6-10-19(15-16)20(22)21-13-11-18(12-14-21)17-8-4-3-5-9-17/h3-10,15,18H,2,11-14H2,1H3
InChIKeyMAIVEOHAYLCMSM-UHFFFAOYSA-N
XLogP4.27
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 54.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze (3-ethylphenyl)-(4-phenylpiperidin-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

[4-[3-(aminomethyl)phenyl]piperidin-1-yl]-(3-benzylphenyl)methanone
CID 139986726
azepan-1-yl-(3-ethylphenyl)methanone
CID 59382478
N-[3-(4-phenylpiperidine-1-carbonyl)phenyl]ethanesulfonamide
CID 24672674
ethane;(3-ethylphenyl)-morpholin-4-ylmethanone
CID 143725238
[4-(5,5-dimethylhexyl)piperidin-1-yl]-(3-ethylphenyl)methanone
CID 158137555
3-[(4-phenylpiperidin-1-yl)methyl]benzoic acid
CID 122028587
[4-[3-(aminomethyl)phenyl]piperidin-1-yl]-(3-hydroxyphenyl)methanone
CID 23587339
[3-(methoxymethyl)phenyl]-[(3R)-3-phenylpiperidin-1-yl]methanone
CID 125171560
[4-(methylsulfonylmethyl)phenyl]-(4-phenylpiperidin-1-yl)methanone
CID 39580416
(3,4-dimethoxyphenyl)-[4-(4-ethylphenyl)piperidin-1-yl]methanone
CID 70598788
(4-phenylpiperidin-1-yl)-(3-pyrrolidin-1-ylsulfonylphenyl)methanone
CID 24660134
(3,4-dihydroxyphenyl)-[4-[3-(ethylaminomethyl)phenyl]piperidin-1-yl]methanone
CID 163533823

Frequently Asked Questions

What is the IUPAC name of (3-ethylphenyl)-(4-phenylpiperidin-1-yl)methanone?
The IUPAC name of (3-ethylphenyl)-(4-phenylpiperidin-1-yl)methanone (CID 90124178) is (3-ethylphenyl)-(4-phenylpiperidin-1-yl)methanone.
What is the SMILES notation for (3-ethylphenyl)-(4-phenylpiperidin-1-yl)methanone?
The canonical SMILES for (3-ethylphenyl)-(4-phenylpiperidin-1-yl)methanone is CCc1cccc(C(=O)N2CCC(c3ccccc3)CC2)c1.
What is the InChIKey of (3-ethylphenyl)-(4-phenylpiperidin-1-yl)methanone?
The InChIKey is MAIVEOHAYLCMSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO/c1-2-16-7-6-10-19(15-16)20(22)21-13-11-18(12-14-21)17-8-4-3-5-9-17/h3-10,15,18H,2,11-14H2,1H3.
What are the key properties of (3-ethylphenyl)-(4-phenylpiperidin-1-yl)methanone?
(3-ethylphenyl)-(4-phenylpiperidin-1-yl)methanone has a molecular weight of 293.41 g/mol, XLogP of 4.27, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethylphenyl)-(4-phenylpiperidin-1-yl)methanone is sourced from PubChem (CID 90124178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).