N-[2-(3,3-diphenylpiperidin-1-yl)-2-oxoethyl]-2-methylpropanamide

C23H28N2O2 — CID 72841382

IUPACN-[2-(3,3-diphenylpiperidin-1-yl)-2-oxoethyl]-2-methylpropanamide
SMILESCC(C)C(=O)NCC(=O)N1CCCC(c2ccccc2)(c2ccccc2)C1
InChIInChI=1S/C23H28N2O2/c1-18(2)22(27)24-16-21(26)25-15-9-14-23(17-25,19-10-5-3-6-11-19)20-12-7-4-8-13-20/h3-8,10-13,18H,9,14-17H2,1-2H3,(H,24,27)
InChIKeyZTIUEVOSCJDUMW-UHFFFAOYSA-N
MW364.49 g/mol
LogP3.37
Rot. Bonds5

About N-[2-(3,3-diphenylpiperidin-1-yl)-2-oxoethyl]-2-methylpropanamide

N-[2-(3,3-diphenylpiperidin-1-yl)-2-oxoethyl]-2-methylpropanamide (PubChem CID 72841382) has the molecular formula C23H28N2O2 and a molecular weight of 364.49 g/mol. Its IUPAC name is N-[2-(3,3-diphenylpiperidin-1-yl)-2-oxoethyl]-2-methylpropanamide.

Molecular Properties

Compound NameN-[2-(3,3-diphenylpiperidin-1-yl)-2-oxoethyl]-2-methylpropanamide
PubChem CID72841382
Molecular FormulaC23H28N2O2
Molecular Weight364.49 g/mol
Exact Mass364.22
IUPAC NameN-[2-(3,3-diphenylpiperidin-1-yl)-2-oxoethyl]-2-methylpropanamide
SMILESCC(C)C(=O)NCC(=O)N1CCCC(c2ccccc2)(c2ccccc2)C1
InChIInChI=1S/C23H28N2O2/c1-18(2)22(27)24-16-21(26)25-15-9-14-23(17-25,19-10-5-3-6-11-19)20-12-7-4-8-13-20/h3-8,10-13,18H,9,14-17H2,1-2H3,(H,24,27)
InChIKeyZTIUEVOSCJDUMW-UHFFFAOYSA-N
XLogP3.37
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.49
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-1-(3,3-diphenylpiperidin-1-yl)-2-hydroxypropan-1-one
CID 97270691
(2S)-2-amino-1-(3,3-diphenylpiperidin-1-yl)propan-1-one;hydrochloride
CID 154900068
1-(3,3-diphenylpiperidin-1-yl)-2-pyridin-3-ylethanone
CID 72933718
[2-[(3S)-3-methyl-3-phenylpiperidin-1-yl]-2-oxoethyl]urea
CID 97141328
2-methyl-N-[2-oxo-2-[(5S)-9-(3-phenylpropyl)-2,9-diazaspiro[4.5]decan-2-yl]ethyl]propanamide
CID 126426416
2-anilino-1-(3,3-dimethylpiperidin-1-yl)ethanone;hydrochloride
CID 119734687
2-[2-(3,3-dimethylpiperidin-1-yl)-2-oxoethyl]benzoic acid
CID 115923844
2-(cyclopropylmethylamino)-1-(3-methyl-3-phenylpiperidin-1-yl)ethanone
CID 119786969
2-methyl-N-[2-oxo-2-[3-oxo-2-(pyridin-3-ylmethyl)-2,8-diazaspiro[5.5]undecan-8-yl]ethyl]propanamide
CID 70707164
2-methyl-N-[2-oxo-2-[(6S)-3-oxo-2-(pyridin-3-ylmethyl)-2,8-diazaspiro[5.5]undecan-8-yl]ethyl]propanamide
CID 95873898
1-(3,3-diphenylpiperidin-1-yl)-4-(1,2,4-triazol-1-yl)butan-1-one
CID 72854237
N-[2-(2-methylpropanoylamino)ethyl]-1-phenylcyclobutane-1-carboxamide
CID 24666491

Frequently Asked Questions

What is the IUPAC name of N-[2-(3,3-diphenylpiperidin-1-yl)-2-oxoethyl]-2-methylpropanamide?
The IUPAC name of N-[2-(3,3-diphenylpiperidin-1-yl)-2-oxoethyl]-2-methylpropanamide (CID 72841382) is N-[2-(3,3-diphenylpiperidin-1-yl)-2-oxoethyl]-2-methylpropanamide.
What is the SMILES notation for N-[2-(3,3-diphenylpiperidin-1-yl)-2-oxoethyl]-2-methylpropanamide?
The canonical SMILES for N-[2-(3,3-diphenylpiperidin-1-yl)-2-oxoethyl]-2-methylpropanamide is CC(C)C(=O)NCC(=O)N1CCCC(c2ccccc2)(c2ccccc2)C1.
What is the InChIKey of N-[2-(3,3-diphenylpiperidin-1-yl)-2-oxoethyl]-2-methylpropanamide?
The InChIKey is ZTIUEVOSCJDUMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N2O2/c1-18(2)22(27)24-16-21(26)25-15-9-14-23(17-25,19-10-5-3-6-11-19)20-12-7-4-8-13-20/h3-8,10-13,18H,9,14-17H2,1-2H3,(H,24,27).
What are the key properties of N-[2-(3,3-diphenylpiperidin-1-yl)-2-oxoethyl]-2-methylpropanamide?
N-[2-(3,3-diphenylpiperidin-1-yl)-2-oxoethyl]-2-methylpropanamide has a molecular weight of 364.49 g/mol, XLogP of 3.37, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3,3-diphenylpiperidin-1-yl)-2-oxoethyl]-2-methylpropanamide is sourced from PubChem (CID 72841382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).