6-(methoxymethyl)-1-methyl-5-(4-phenylpiperazine-1-carbonyl)piperidin-2-one

C19H27N3O3 — CID 171142565

IUPAC6-(methoxymethyl)-1-methyl-5-(4-phenylpiperazine-1-carbonyl)piperidin-2-one
SMILESCOCC1C(C(=O)N2CCN(c3ccccc3)CC2)CCC(=O)N1C
InChIInChI=1S/C19H27N3O3/c1-20-17(14-25-2)16(8-9-18(20)23)19(24)22-12-10-21(11-13-22)15-6-4-3-5-7-15/h3-7,16-17H,8-14H2,1-2H3
InChIKeyRGVBXTHNAWLOJC-UHFFFAOYSA-N
MW345.44 g/mol
LogP1.22
Rot. Bonds4

About 6-(methoxymethyl)-1-methyl-5-(4-phenylpiperazine-1-carbonyl)piperidin-2-one

6-(methoxymethyl)-1-methyl-5-(4-phenylpiperazine-1-carbonyl)piperidin-2-one (PubChem CID 171142565) has the molecular formula C19H27N3O3 and a molecular weight of 345.44 g/mol. Its IUPAC name is 6-(methoxymethyl)-1-methyl-5-(4-phenylpiperazine-1-carbonyl)piperidin-2-one.

Molecular Properties

Compound Name6-(methoxymethyl)-1-methyl-5-(4-phenylpiperazine-1-carbonyl)piperidin-2-one
PubChem CID171142565
Molecular FormulaC19H27N3O3
Molecular Weight345.44 g/mol
Exact Mass345.21
IUPAC Name6-(methoxymethyl)-1-methyl-5-(4-phenylpiperazine-1-carbonyl)piperidin-2-one
SMILESCOCC1C(C(=O)N2CCN(c3ccccc3)CC2)CCC(=O)N1C
InChIInChI=1S/C19H27N3O3/c1-20-17(14-25-2)16(8-9-18(20)23)19(24)22-12-10-21(11-13-22)15-6-4-3-5-7-15/h3-7,16-17H,8-14H2,1-2H3
InChIKeyRGVBXTHNAWLOJC-UHFFFAOYSA-N
XLogP1.22
TPSA53.09 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.44
LogP ≤ 51.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

ethane;(1-methylpiperidin-4-yl)-(4-phenylpiperazin-1-yl)methanone
CID 171069680
[1-[[2-(4-phenylpiperazine-1-carbonyl)-1,2,3,4-tetrahydronaphthalen-1-yl]oxy]-1,2,3,4-tetrahydronaphthalen-2-yl]-(4-phenylpiperazin-1-yl)methanone
CID 142761942
1-phenyl-5-(4-phenylpiperazine-1-carbonyl)pyrrolidin-2-one
CID 110412075
2-(4-phenylpiperazine-1-carbonyl)cyclohexane-1-carboxylic acid
CID 2933500
(2-hydroxycyclopentyl)-(4-phenylpiperazin-1-yl)methanone
CID 110013572
1-(4-methylphenyl)-5-(4-phenylpiperazine-1-carbonyl)pyrrolidin-2-one
CID 110373773
methyl 4-(4-phenylpiperazine-1-carbonyl)piperidine-1-carboxylate
CID 110754124
1-methyl-5-(4-methylpiperidine-1-carbonyl)-6-phenylpiperidin-2-one
CID 56730517
(1S,2S,5R)-5-(2,5-dioxopyrrolidin-1-yl)-N-hydroxy-2-(4-phenylpiperazine-1-carbonyl)cyclohexane-1-carboxamide
CID 87348210
1-[(2-chlorophenyl)methyl]-5-(4-phenylpiperazine-1-carbonyl)pyrrolidin-2-one
CID 139023933
[2-(4-phenylpiperazine-1-carbonyl)cyclopropyl]-piperidin-1-ylmethanone
CID 109132218
(5R,6S)-5-[4-(2-fluorophenyl)piperazine-1-carbonyl]-6-(4-methoxyphenyl)-1-methylpiperidin-2-one
CID 95740284

Frequently Asked Questions

What is the IUPAC name of 6-(methoxymethyl)-1-methyl-5-(4-phenylpiperazine-1-carbonyl)piperidin-2-one?
The IUPAC name of 6-(methoxymethyl)-1-methyl-5-(4-phenylpiperazine-1-carbonyl)piperidin-2-one (CID 171142565) is 6-(methoxymethyl)-1-methyl-5-(4-phenylpiperazine-1-carbonyl)piperidin-2-one.
What is the SMILES notation for 6-(methoxymethyl)-1-methyl-5-(4-phenylpiperazine-1-carbonyl)piperidin-2-one?
The canonical SMILES for 6-(methoxymethyl)-1-methyl-5-(4-phenylpiperazine-1-carbonyl)piperidin-2-one is COCC1C(C(=O)N2CCN(c3ccccc3)CC2)CCC(=O)N1C.
What is the InChIKey of 6-(methoxymethyl)-1-methyl-5-(4-phenylpiperazine-1-carbonyl)piperidin-2-one?
The InChIKey is RGVBXTHNAWLOJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N3O3/c1-20-17(14-25-2)16(8-9-18(20)23)19(24)22-12-10-21(11-13-22)15-6-4-3-5-7-15/h3-7,16-17H,8-14H2,1-2H3.
What are the key properties of 6-(methoxymethyl)-1-methyl-5-(4-phenylpiperazine-1-carbonyl)piperidin-2-one?
6-(methoxymethyl)-1-methyl-5-(4-phenylpiperazine-1-carbonyl)piperidin-2-one has a molecular weight of 345.44 g/mol, XLogP of 1.22, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(methoxymethyl)-1-methyl-5-(4-phenylpiperazine-1-carbonyl)piperidin-2-one is sourced from PubChem (CID 171142565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).