1-methyl-5-[3-(methylamino)piperidine-1-carbonyl]-6-phenylpiperidin-2-one;hydrochloride

C19H28ClN3O2 — CID 119490707

IUPAC1-methyl-5-[3-(methylamino)piperidine-1-carbonyl]-6-phenylpiperidin-2-one;hydrochloride
SMILESCNC1CCCN(C(=O)C2CCC(=O)N(C)C2c2ccccc2)C1.Cl
InChIInChI=1S/C19H27N3O2.ClH/c1-20-15-9-6-12-22(13-15)19(24)16-10-11-17(23)21(2)18(16)14-7-4-3-5-8-14;/h3-5,7-8,15-16,18,20H,6,9-13H2,1-2H3;1H
InChIKeyUNJGWCHUSUVHMF-UHFFFAOYSA-N
MW365.91 g/mol
LogP2.23
Rot. Bonds3

About 1-methyl-5-[3-(methylamino)piperidine-1-carbonyl]-6-phenylpiperidin-2-one;hydrochloride

1-methyl-5-[3-(methylamino)piperidine-1-carbonyl]-6-phenylpiperidin-2-one;hydrochloride (PubChem CID 119490707) has the molecular formula C19H28ClN3O2 and a molecular weight of 365.91 g/mol. Its IUPAC name is 1-methyl-5-[3-(methylamino)piperidine-1-carbonyl]-6-phenylpiperidin-2-one;hydrochloride.

Molecular Properties

Compound Name1-methyl-5-[3-(methylamino)piperidine-1-carbonyl]-6-phenylpiperidin-2-one;hydrochloride
PubChem CID119490707
Molecular FormulaC19H28ClN3O2
Molecular Weight365.91 g/mol
Exact Mass365.19
IUPAC Name1-methyl-5-[3-(methylamino)piperidine-1-carbonyl]-6-phenylpiperidin-2-one;hydrochloride
SMILESCNC1CCCN(C(=O)C2CCC(=O)N(C)C2c2ccccc2)C1.Cl
InChIInChI=1S/C19H27N3O2.ClH/c1-20-15-9-6-12-22(13-15)19(24)16-10-11-17(23)21(2)18(16)14-7-4-3-5-8-14;/h3-5,7-8,15-16,18,20H,6,9-13H2,1-2H3;1H
InChIKeyUNJGWCHUSUVHMF-UHFFFAOYSA-N
XLogP2.23
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.91
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-5-(4-methylpiperidine-1-carbonyl)-6-phenylpiperidin-2-one
CID 56730517
1-methyl-4-[3-(methylamino)piperidine-1-carbonyl]-5-pyridin-3-ylpyrrolidin-2-one
CID 119490576
5-[3-(aminomethyl)pyrrolidine-1-carbonyl]-1-methyl-6-phenylpiperidin-2-one
CID 119485273
(5R,6S)-1-methyl-6-(4-methylphenyl)-5-(piperidine-1-carbonyl)piperidin-2-one
CID 95738417
(5R,6R)-1-methyl-6-(4-methylphenyl)-5-(piperidine-1-carbonyl)piperidin-2-one
CID 95738418
(5S,6S)-6-(3-fluorophenyl)-1-methyl-5-(pyrrolidine-1-carbonyl)piperidin-2-one
CID 95740162
(5S,6R)-6-(3-fluorophenyl)-1-methyl-5-(piperidine-1-carbonyl)piperidin-2-one
CID 95740187
[3-(methylamino)piperidin-1-yl]-(1,2,3,4-tetrahydronaphthalen-2-yl)methanone
CID 107125909
6-(4-fluorophenyl)-1-methyl-5-[3-(1-methylbenzimidazol-2-yl)piperidine-1-carbonyl]piperidin-2-one
CID 91947066
1-[2-(3-chlorophenyl)-1-methyl-6-oxopiperidine-3-carbonyl]pyrrolidine-3-carboxylic acid
CID 119354141
6-(2-fluorophenyl)-1-methyl-5-(pyrrolidine-1-carbonyl)piperidin-2-one
CID 56730472
(5R,6S)-4-methyl-6-[(3R)-3-methylpiperidine-1-carbonyl]-5-phenylmorpholin-3-one
CID 98768939

Frequently Asked Questions

What is the IUPAC name of 1-methyl-5-[3-(methylamino)piperidine-1-carbonyl]-6-phenylpiperidin-2-one;hydrochloride?
The IUPAC name of 1-methyl-5-[3-(methylamino)piperidine-1-carbonyl]-6-phenylpiperidin-2-one;hydrochloride (CID 119490707) is 1-methyl-5-[3-(methylamino)piperidine-1-carbonyl]-6-phenylpiperidin-2-one;hydrochloride.
What is the SMILES notation for 1-methyl-5-[3-(methylamino)piperidine-1-carbonyl]-6-phenylpiperidin-2-one;hydrochloride?
The canonical SMILES for 1-methyl-5-[3-(methylamino)piperidine-1-carbonyl]-6-phenylpiperidin-2-one;hydrochloride is CNC1CCCN(C(=O)C2CCC(=O)N(C)C2c2ccccc2)C1.Cl.
What is the InChIKey of 1-methyl-5-[3-(methylamino)piperidine-1-carbonyl]-6-phenylpiperidin-2-one;hydrochloride?
The InChIKey is UNJGWCHUSUVHMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N3O2.ClH/c1-20-15-9-6-12-22(13-15)19(24)16-10-11-17(23)21(2)18(16)14-7-4-3-5-8-14;/h3-5,7-8,15-16,18,20H,6,9-13H2,1-2H3;1H.
What are the key properties of 1-methyl-5-[3-(methylamino)piperidine-1-carbonyl]-6-phenylpiperidin-2-one;hydrochloride?
1-methyl-5-[3-(methylamino)piperidine-1-carbonyl]-6-phenylpiperidin-2-one;hydrochloride has a molecular weight of 365.91 g/mol, XLogP of 2.23, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-5-[3-(methylamino)piperidine-1-carbonyl]-6-phenylpiperidin-2-one;hydrochloride is sourced from PubChem (CID 119490707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).