1-(3-aminopiperidin-1-yl)-3,3-diphenylpropan-1-one;hydrochloride

C20H25ClN2O — CID 119380726

IUPAC1-(3-aminopiperidin-1-yl)-3,3-diphenylpropan-1-one;hydrochloride
SMILESCl.NC1CCCN(C(=O)CC(c2ccccc2)c2ccccc2)C1
InChIInChI=1S/C20H24N2O.ClH/c21-18-12-7-13-22(15-18)20(23)14-19(16-8-3-1-4-9-16)17-10-5-2-6-11-17;/h1-6,8-11,18-19H,7,12-15,21H2;1H
InChIKeyQJXILCHSGHSDDS-UHFFFAOYSA-N
MW344.89 g/mol
LogP3.58
Rot. Bonds4

About 1-(3-aminopiperidin-1-yl)-3,3-diphenylpropan-1-one;hydrochloride

1-(3-aminopiperidin-1-yl)-3,3-diphenylpropan-1-one;hydrochloride (PubChem CID 119380726) has the molecular formula C20H25ClN2O and a molecular weight of 344.89 g/mol. Its IUPAC name is 1-(3-aminopiperidin-1-yl)-3,3-diphenylpropan-1-one;hydrochloride.

Molecular Properties

Compound Name1-(3-aminopiperidin-1-yl)-3,3-diphenylpropan-1-one;hydrochloride
PubChem CID119380726
Molecular FormulaC20H25ClN2O
Molecular Weight344.89 g/mol
Exact Mass344.17
IUPAC Name1-(3-aminopiperidin-1-yl)-3,3-diphenylpropan-1-one;hydrochloride
SMILESCl.NC1CCCN(C(=O)CC(c2ccccc2)c2ccccc2)C1
InChIInChI=1S/C20H24N2O.ClH/c21-18-12-7-13-22(15-18)20(23)14-19(16-8-3-1-4-9-16)17-10-5-2-6-11-17;/h1-6,8-11,18-19H,7,12-15,21H2;1H
InChIKeyQJXILCHSGHSDDS-UHFFFAOYSA-N
XLogP3.58
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.89
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-aminopiperidin-1-yl)-3,3-diphenylpropan-1-one
CID 28804060
1-(3-aminopiperidin-1-yl)-2-phenylethanone;hydrochloride
CID 112756506
N-[2-(3-aminopiperidin-1-yl)-2-oxoethyl]benzamide;hydrochloride
CID 119380136
1-(3-aminopiperidin-1-yl)-2-phenoxyethanone;hydrochloride
CID 119377679
1-[(3R)-3-aminopyrrolidin-1-yl]-3,4-diphenylbutan-1-one;hydrochloride
CID 119411312
N-[2-[(3S)-3-aminopiperidin-1-yl]-2-oxoethyl]benzamide
CID 166176480
1-[(3R)-3-aminopyrrolidin-1-yl]-4,4,4-trifluoro-3-phenylbutan-1-one
CID 119411236
1-(3-aminopiperidin-1-yl)-3-(4-propan-2-ylphenyl)butan-1-one
CID 119378198
(3S)-1-(3,3-diphenylpropanoyl)-N-phenylpiperidine-3-carboxamide
CID 27745627
N-[3-[(3R)-3-aminopyrrolidin-1-yl]-3-oxo-1-phenylpropyl]acetamide;hydrochloride
CID 119411136
1-(3-aminopiperidin-1-yl)-3-(4-methylphenyl)pentan-1-one;hydrochloride
CID 119377565
(3R)-1-(3-amino-3-phenylpropanoyl)piperidine-3-carboxylic acid
CID 81120276

Frequently Asked Questions

What is the IUPAC name of 1-(3-aminopiperidin-1-yl)-3,3-diphenylpropan-1-one;hydrochloride?
The IUPAC name of 1-(3-aminopiperidin-1-yl)-3,3-diphenylpropan-1-one;hydrochloride (CID 119380726) is 1-(3-aminopiperidin-1-yl)-3,3-diphenylpropan-1-one;hydrochloride.
What is the SMILES notation for 1-(3-aminopiperidin-1-yl)-3,3-diphenylpropan-1-one;hydrochloride?
The canonical SMILES for 1-(3-aminopiperidin-1-yl)-3,3-diphenylpropan-1-one;hydrochloride is Cl.NC1CCCN(C(=O)CC(c2ccccc2)c2ccccc2)C1.
What is the InChIKey of 1-(3-aminopiperidin-1-yl)-3,3-diphenylpropan-1-one;hydrochloride?
The InChIKey is QJXILCHSGHSDDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O.ClH/c21-18-12-7-13-22(15-18)20(23)14-19(16-8-3-1-4-9-16)17-10-5-2-6-11-17;/h1-6,8-11,18-19H,7,12-15,21H2;1H.
What are the key properties of 1-(3-aminopiperidin-1-yl)-3,3-diphenylpropan-1-one;hydrochloride?
1-(3-aminopiperidin-1-yl)-3,3-diphenylpropan-1-one;hydrochloride has a molecular weight of 344.89 g/mol, XLogP of 3.58, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-aminopiperidin-1-yl)-3,3-diphenylpropan-1-one;hydrochloride is sourced from PubChem (CID 119380726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).