[1-(morpholine-2-carbonyl)piperidin-4-yl]-phenylmethanone;hydrochloride

C17H23ClN2O3 — CID 119699768

IUPAC[1-(morpholine-2-carbonyl)piperidin-4-yl]-phenylmethanone;hydrochloride
SMILESCl.O=C(c1ccccc1)C1CCN(C(=O)C2CNCCO2)CC1
InChIInChI=1S/C17H22N2O3.ClH/c20-16(13-4-2-1-3-5-13)14-6-9-19(10-7-14)17(21)15-12-18-8-11-22-15;/h1-5,14-15,18H,6-12H2;1H
InChIKeyGVFBNMYFDZSOFO-UHFFFAOYSA-N
MW338.83 g/mol
LogP1.52
Rot. Bonds3

About [1-(morpholine-2-carbonyl)piperidin-4-yl]-phenylmethanone;hydrochloride

[1-(morpholine-2-carbonyl)piperidin-4-yl]-phenylmethanone;hydrochloride (PubChem CID 119699768) has the molecular formula C17H23ClN2O3 and a molecular weight of 338.83 g/mol. Its IUPAC name is [1-(morpholine-2-carbonyl)piperidin-4-yl]-phenylmethanone;hydrochloride.

Molecular Properties

Compound Name[1-(morpholine-2-carbonyl)piperidin-4-yl]-phenylmethanone;hydrochloride
PubChem CID119699768
Molecular FormulaC17H23ClN2O3
Molecular Weight338.83 g/mol
Exact Mass338.14
IUPAC Name[1-(morpholine-2-carbonyl)piperidin-4-yl]-phenylmethanone;hydrochloride
SMILESCl.O=C(c1ccccc1)C1CCN(C(=O)C2CNCCO2)CC1
InChIInChI=1S/C17H22N2O3.ClH/c20-16(13-4-2-1-3-5-13)14-6-9-19(10-7-14)17(21)15-12-18-8-11-22-15;/h1-5,14-15,18H,6-12H2;1H
InChIKeyGVFBNMYFDZSOFO-UHFFFAOYSA-N
XLogP1.52
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.83
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

morpholin-2-yl-[4-(2-phenylethyl)piperidin-1-yl]methanone
CID 119698790
[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]-phenylmethanone;hydrochloride
CID 120920722
morpholin-2-yl(piperidin-1-yl)methanone;hydrochloride
CID 71298615
[4-(benzenesulfonyl)piperazin-1-yl]-morpholin-2-ylmethanone
CID 119678332
morpholin-2-yl-(4-piperidin-1-ylpiperidin-1-yl)methanone;dihydrochloride
CID 119842984
N-(5-methyl-2-pyridinyl)-1-(morpholine-2-carbonyl)piperidine-4-carboxamide;dihydrochloride
CID 119855179
[4-(2,3-dichlorobenzoyl)piperazin-1-yl]-morpholin-2-ylmethanone;hydrochloride
CID 119720695
1-[4-(morpholine-2-carbonyl)piperazin-1-yl]-2-phenoxyethanone
CID 74237629
(3-ethyl-4-phenylpiperidin-1-yl)-morpholin-2-ylmethanone
CID 119817683
[4-(furan-2-carbonyl)piperazin-1-yl]-morpholin-2-ylmethanone;hydrochloride
CID 119673067
[1-(2,3-dihydro-1,4-benzodioxine-3-carbonyl)piperidin-4-yl]-phenylmethanone
CID 18164983
[4-(4-chlorobenzoyl)-1,4-diazepan-1-yl]-morpholin-2-ylmethanone;hydrochloride
CID 119747817

Frequently Asked Questions

What is the IUPAC name of [1-(morpholine-2-carbonyl)piperidin-4-yl]-phenylmethanone;hydrochloride?
The IUPAC name of [1-(morpholine-2-carbonyl)piperidin-4-yl]-phenylmethanone;hydrochloride (CID 119699768) is [1-(morpholine-2-carbonyl)piperidin-4-yl]-phenylmethanone;hydrochloride.
What is the SMILES notation for [1-(morpholine-2-carbonyl)piperidin-4-yl]-phenylmethanone;hydrochloride?
The canonical SMILES for [1-(morpholine-2-carbonyl)piperidin-4-yl]-phenylmethanone;hydrochloride is Cl.O=C(c1ccccc1)C1CCN(C(=O)C2CNCCO2)CC1.
What is the InChIKey of [1-(morpholine-2-carbonyl)piperidin-4-yl]-phenylmethanone;hydrochloride?
The InChIKey is GVFBNMYFDZSOFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O3.ClH/c20-16(13-4-2-1-3-5-13)14-6-9-19(10-7-14)17(21)15-12-18-8-11-22-15;/h1-5,14-15,18H,6-12H2;1H.
What are the key properties of [1-(morpholine-2-carbonyl)piperidin-4-yl]-phenylmethanone;hydrochloride?
[1-(morpholine-2-carbonyl)piperidin-4-yl]-phenylmethanone;hydrochloride has a molecular weight of 338.83 g/mol, XLogP of 1.52, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(morpholine-2-carbonyl)piperidin-4-yl]-phenylmethanone;hydrochloride is sourced from PubChem (CID 119699768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).