[1-[4-(methoxymethyl)benzoyl]piperidin-2-yl]-morpholin-4-ylmethanone

C19H26N2O4 — CID 136522845

IUPAC[1-[4-(methoxymethyl)benzoyl]piperidin-2-yl]-morpholin-4-ylmethanone
SMILESCOCc1ccc(C(=O)N2CCCCC2C(=O)N2CCOCC2)cc1
InChIInChI=1S/C19H26N2O4/c1-24-14-15-5-7-16(8-6-15)18(22)21-9-3-2-4-17(21)19(23)20-10-12-25-13-11-20/h5-8,17H,2-4,9-14H2,1H3
InChIKeyHXARSPKGZRODHN-UHFFFAOYSA-N
MW346.43 g/mol
LogP1.69
Rot. Bonds4

About [1-[4-(methoxymethyl)benzoyl]piperidin-2-yl]-morpholin-4-ylmethanone

[1-[4-(methoxymethyl)benzoyl]piperidin-2-yl]-morpholin-4-ylmethanone (PubChem CID 136522845) has the molecular formula C19H26N2O4 and a molecular weight of 346.43 g/mol. Its IUPAC name is [1-[4-(methoxymethyl)benzoyl]piperidin-2-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[1-[4-(methoxymethyl)benzoyl]piperidin-2-yl]-morpholin-4-ylmethanone
PubChem CID136522845
Molecular FormulaC19H26N2O4
Molecular Weight346.43 g/mol
Exact Mass346.19
IUPAC Name[1-[4-(methoxymethyl)benzoyl]piperidin-2-yl]-morpholin-4-ylmethanone
SMILESCOCc1ccc(C(=O)N2CCCCC2C(=O)N2CCOCC2)cc1
InChIInChI=1S/C19H26N2O4/c1-24-14-15-5-7-16(8-6-15)18(22)21-9-3-2-4-17(21)19(23)20-10-12-25-13-11-20/h5-8,17H,2-4,9-14H2,1H3
InChIKeyHXARSPKGZRODHN-UHFFFAOYSA-N
XLogP1.69
TPSA59.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.43
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 1-[4-(methoxymethyl)benzoyl]piperidine-2-carboxylate
CID 115280090
[1-[3-(methoxymethyl)benzoyl]piperidin-2-yl]-pyrrolidin-1-ylmethanone
CID 51098117
[1-(furan-3-carbonyl)piperidin-2-yl]-morpholin-4-ylmethanone
CID 4089666
azepan-1-yl-[1-[4-(methoxymethyl)benzoyl]piperidin-4-yl]methanone
CID 134029877
[2-(1-aminoethyl)piperidin-1-yl]-[4-(methoxymethyl)phenyl]methanone;hydrochloride
CID 119436994
[1-(5-bromofuran-2-carbonyl)pyrrolidin-2-yl]-morpholin-4-ylmethanone
CID 60707747
methyl 1-[4-(hydroxymethyl)benzoyl]piperidine-2-carboxylate
CID 115535703
[2-(cyclohexylmethyl)pyrrolidin-1-yl]-[4-(methoxymethyl)phenyl]methanone
CID 60604837
1-(4-methylphenyl)-4-[(2S)-2-(morpholine-4-carbonyl)pyrrolidin-1-yl]butane-1,4-dione
CID 110305871
[(2S)-1-(3-fluorobenzoyl)pyrrolidin-2-yl]-morpholin-4-ylmethanone
CID 110285997
[1-[2-(4-methoxyphenyl)ethyl]piperidin-2-yl]-morpholin-4-ylmethanone
CID 136522970
[4-(methoxymethyl)phenyl]-[(2R)-2-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]methanone
CID 95762290

Frequently Asked Questions

What is the IUPAC name of [1-[4-(methoxymethyl)benzoyl]piperidin-2-yl]-morpholin-4-ylmethanone?
The IUPAC name of [1-[4-(methoxymethyl)benzoyl]piperidin-2-yl]-morpholin-4-ylmethanone (CID 136522845) is [1-[4-(methoxymethyl)benzoyl]piperidin-2-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [1-[4-(methoxymethyl)benzoyl]piperidin-2-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [1-[4-(methoxymethyl)benzoyl]piperidin-2-yl]-morpholin-4-ylmethanone is COCc1ccc(C(=O)N2CCCCC2C(=O)N2CCOCC2)cc1.
What is the InChIKey of [1-[4-(methoxymethyl)benzoyl]piperidin-2-yl]-morpholin-4-ylmethanone?
The InChIKey is HXARSPKGZRODHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O4/c1-24-14-15-5-7-16(8-6-15)18(22)21-9-3-2-4-17(21)19(23)20-10-12-25-13-11-20/h5-8,17H,2-4,9-14H2,1H3.
What are the key properties of [1-[4-(methoxymethyl)benzoyl]piperidin-2-yl]-morpholin-4-ylmethanone?
[1-[4-(methoxymethyl)benzoyl]piperidin-2-yl]-morpholin-4-ylmethanone has a molecular weight of 346.43 g/mol, XLogP of 1.69, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[4-(methoxymethyl)benzoyl]piperidin-2-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 136522845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).