2-amino-2-phenyl-1-(4-phenylpiperidin-1-yl)ethanone

C19H22N2O — CID 119278410

IUPAC2-amino-2-phenyl-1-(4-phenylpiperidin-1-yl)ethanone
SMILESNC(C(=O)N1CCC(c2ccccc2)CC1)c1ccccc1
InChIInChI=1S/C19H22N2O/c20-18(17-9-5-2-6-10-17)19(22)21-13-11-16(12-14-21)15-7-3-1-4-8-15/h1-10,16,18H,11-14,20H2
InChIKeyCNFULITZQPEQAF-UHFFFAOYSA-N
MW294.40 g/mol
LogP3.09
Rot. Bonds3

About 2-amino-2-phenyl-1-(4-phenylpiperidin-1-yl)ethanone

2-amino-2-phenyl-1-(4-phenylpiperidin-1-yl)ethanone (PubChem CID 119278410) has the molecular formula C19H22N2O and a molecular weight of 294.40 g/mol. Its IUPAC name is 2-amino-2-phenyl-1-(4-phenylpiperidin-1-yl)ethanone.

Molecular Properties

Compound Name2-amino-2-phenyl-1-(4-phenylpiperidin-1-yl)ethanone
PubChem CID119278410
Molecular FormulaC19H22N2O
Molecular Weight294.40 g/mol
Exact Mass294.17
IUPAC Name2-amino-2-phenyl-1-(4-phenylpiperidin-1-yl)ethanone
SMILESNC(C(=O)N1CCC(c2ccccc2)CC1)c1ccccc1
InChIInChI=1S/C19H22N2O/c20-18(17-9-5-2-6-10-17)19(22)21-13-11-16(12-14-21)15-7-3-1-4-8-15/h1-10,16,18H,11-14,20H2
InChIKeyCNFULITZQPEQAF-UHFFFAOYSA-N
XLogP3.09
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-2-phenyl-1-(3-phenylpyrrolidin-1-yl)ethanone;hydrochloride
CID 119290269
(2R)-2-amino-1-(4-tert-butylpiperidin-1-yl)-2-phenylethanone
CID 62083998
1-(2-amino-2-phenylacetyl)piperidine-4-carboxamide
CID 24695590
(2S)-2-amino-3-methyl-1-(4-phenylpiperidin-1-yl)butan-1-one
CID 61165041
2-amino-2-phenyl-1-pyrrolidin-1-ylethanone
CID 24693981
(2R)-2-amino-1-(4-methoxypiperidin-1-yl)-2-phenylethanone
CID 61156075
2-amino-1-(3,4-dimethylpiperidin-1-yl)-2-phenylethanone
CID 86784489
(2S)-2-amino-1-(4-phenylpiperidin-1-yl)butan-1-one
CID 79024088
(2S)-2-amino-1-(azocan-1-yl)-2-phenylethanone
CID 28801220
2,2-diphenyl-1-(3-phenylpyrrolidin-1-yl)ethanone
CID 2910235
(2S)-1-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-2-amino-2-phenylethanone
CID 104897194
2-amino-2-phenyl-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethanone;dihydrochloride
CID 119843387

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-phenyl-1-(4-phenylpiperidin-1-yl)ethanone?
The IUPAC name of 2-amino-2-phenyl-1-(4-phenylpiperidin-1-yl)ethanone (CID 119278410) is 2-amino-2-phenyl-1-(4-phenylpiperidin-1-yl)ethanone.
What is the SMILES notation for 2-amino-2-phenyl-1-(4-phenylpiperidin-1-yl)ethanone?
The canonical SMILES for 2-amino-2-phenyl-1-(4-phenylpiperidin-1-yl)ethanone is NC(C(=O)N1CCC(c2ccccc2)CC1)c1ccccc1.
What is the InChIKey of 2-amino-2-phenyl-1-(4-phenylpiperidin-1-yl)ethanone?
The InChIKey is CNFULITZQPEQAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O/c20-18(17-9-5-2-6-10-17)19(22)21-13-11-16(12-14-21)15-7-3-1-4-8-15/h1-10,16,18H,11-14,20H2.
What are the key properties of 2-amino-2-phenyl-1-(4-phenylpiperidin-1-yl)ethanone?
2-amino-2-phenyl-1-(4-phenylpiperidin-1-yl)ethanone has a molecular weight of 294.40 g/mol, XLogP of 3.09, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-phenyl-1-(4-phenylpiperidin-1-yl)ethanone is sourced from PubChem (CID 119278410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).