(2-methyl-6-phenylmorpholin-4-yl)-piperidin-2-ylmethanone;hydrochloride

C17H25ClN2O2 — CID 119304765

IUPAC(2-methyl-6-phenylmorpholin-4-yl)-piperidin-2-ylmethanone;hydrochloride
SMILESCC1CN(C(=O)C2CCCCN2)CC(c2ccccc2)O1.Cl
InChIInChI=1S/C17H24N2O2.ClH/c1-13-11-19(17(20)15-9-5-6-10-18-15)12-16(21-13)14-7-3-2-4-8-14;/h2-4,7-8,13,15-16,18H,5-6,9-12H2,1H3;1H
InChIKeyDMLWEKIFJWMPHJ-UHFFFAOYSA-N
MW324.85 g/mol
LogP2.54
Rot. Bonds2

About (2-methyl-6-phenylmorpholin-4-yl)-piperidin-2-ylmethanone;hydrochloride

(2-methyl-6-phenylmorpholin-4-yl)-piperidin-2-ylmethanone;hydrochloride (PubChem CID 119304765) has the molecular formula C17H25ClN2O2 and a molecular weight of 324.85 g/mol. Its IUPAC name is (2-methyl-6-phenylmorpholin-4-yl)-piperidin-2-ylmethanone;hydrochloride.

Molecular Properties

Compound Name(2-methyl-6-phenylmorpholin-4-yl)-piperidin-2-ylmethanone;hydrochloride
PubChem CID119304765
Molecular FormulaC17H25ClN2O2
Molecular Weight324.85 g/mol
Exact Mass324.16
IUPAC Name(2-methyl-6-phenylmorpholin-4-yl)-piperidin-2-ylmethanone;hydrochloride
SMILESCC1CN(C(=O)C2CCCCN2)CC(c2ccccc2)O1.Cl
InChIInChI=1S/C17H24N2O2.ClH/c1-13-11-19(17(20)15-9-5-6-10-18-15)12-16(21-13)14-7-3-2-4-8-14;/h2-4,7-8,13,15-16,18H,5-6,9-12H2,1H3;1H
InChIKeyDMLWEKIFJWMPHJ-UHFFFAOYSA-N
XLogP2.54
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.85
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[(2R,6S)-2-methyl-6-phenylmorpholin-4-yl]-[(4R)-1,3-thiazolidin-4-yl]methanone
CID 124591656
[(2R,6R)-2-methyl-6-thiophen-3-ylmorpholin-4-yl]-[(2R)-pyrrolidin-2-yl]methanone
CID 124694505
(2-phenylmorpholin-4-yl)-piperidin-2-ylmethanone
CID 60962617
(3-methyl-4-phenylpiperidin-1-yl)-pyrrolidin-2-ylmethanone;hydrochloride
CID 119336209
cyclohexyl-[2-(2-methyl-6-phenylmorpholine-4-carbonyl)pyrrolidin-1-yl]methanone
CID 47914816
cyclopentyl-[2-methyl-6-(4-methylphenyl)morpholin-4-yl]methanone
CID 110369056
[(2R,6S)-2-(4-fluorophenyl)-6-methylmorpholin-4-yl]-[(4S)-1,3-thiazolidin-4-yl]methanone
CID 124697908
(2-methylmorpholin-4-yl)-[(2R)-piperidin-2-yl]methanone;hydrochloride
CID 119698701
cyclopropyl-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]methanone
CID 110369168
benzyl 4-(2-methyl-6-phenylmorpholine-4-carbonyl)piperidine-1-carboxylate
CID 60587008
[(1R,2R)-2-(furan-2-yl)cyclopropyl]-[(2R,6R)-2-methyl-6-phenylmorpholin-4-yl]methanone
CID 124850593
1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]-2-pyrrolidin-2-ylethanone;hydrochloride
CID 119799317

Frequently Asked Questions

What is the IUPAC name of (2-methyl-6-phenylmorpholin-4-yl)-piperidin-2-ylmethanone;hydrochloride?
The IUPAC name of (2-methyl-6-phenylmorpholin-4-yl)-piperidin-2-ylmethanone;hydrochloride (CID 119304765) is (2-methyl-6-phenylmorpholin-4-yl)-piperidin-2-ylmethanone;hydrochloride.
What is the SMILES notation for (2-methyl-6-phenylmorpholin-4-yl)-piperidin-2-ylmethanone;hydrochloride?
The canonical SMILES for (2-methyl-6-phenylmorpholin-4-yl)-piperidin-2-ylmethanone;hydrochloride is CC1CN(C(=O)C2CCCCN2)CC(c2ccccc2)O1.Cl.
What is the InChIKey of (2-methyl-6-phenylmorpholin-4-yl)-piperidin-2-ylmethanone;hydrochloride?
The InChIKey is DMLWEKIFJWMPHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2.ClH/c1-13-11-19(17(20)15-9-5-6-10-18-15)12-16(21-13)14-7-3-2-4-8-14;/h2-4,7-8,13,15-16,18H,5-6,9-12H2,1H3;1H.
What are the key properties of (2-methyl-6-phenylmorpholin-4-yl)-piperidin-2-ylmethanone;hydrochloride?
(2-methyl-6-phenylmorpholin-4-yl)-piperidin-2-ylmethanone;hydrochloride has a molecular weight of 324.85 g/mol, XLogP of 2.54, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methyl-6-phenylmorpholin-4-yl)-piperidin-2-ylmethanone;hydrochloride is sourced from PubChem (CID 119304765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).