4-(4-methylpiperidine-1-carbonyl)-5-phenyl-1,3-oxazolidin-2-one

C16H20N2O3 — CID 110689071

IUPAC4-(4-methylpiperidine-1-carbonyl)-5-phenyl-1,3-oxazolidin-2-one
SMILESCC1CCN(C(=O)C2NC(=O)OC2c2ccccc2)CC1
InChIInChI=1S/C16H20N2O3/c1-11-7-9-18(10-8-11)15(19)13-14(21-16(20)17-13)12-5-3-2-4-6-12/h2-6,11,13-14H,7-10H2,1H3,(H,17,20)
InChIKeyMEJBHWOBZLFGSU-UHFFFAOYSA-N
MW288.35 g/mol
LogP2.09
Rot. Bonds2

About 4-(4-methylpiperidine-1-carbonyl)-5-phenyl-1,3-oxazolidin-2-one

4-(4-methylpiperidine-1-carbonyl)-5-phenyl-1,3-oxazolidin-2-one (PubChem CID 110689071) has the molecular formula C16H20N2O3 and a molecular weight of 288.35 g/mol. Its IUPAC name is 4-(4-methylpiperidine-1-carbonyl)-5-phenyl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name4-(4-methylpiperidine-1-carbonyl)-5-phenyl-1,3-oxazolidin-2-one
PubChem CID110689071
Molecular FormulaC16H20N2O3
Molecular Weight288.35 g/mol
Exact Mass288.15
IUPAC Name4-(4-methylpiperidine-1-carbonyl)-5-phenyl-1,3-oxazolidin-2-one
SMILESCC1CCN(C(=O)C2NC(=O)OC2c2ccccc2)CC1
InChIInChI=1S/C16H20N2O3/c1-11-7-9-18(10-8-11)15(19)13-14(21-16(20)17-13)12-5-3-2-4-6-12/h2-6,11,13-14H,7-10H2,1H3,(H,17,20)
InChIKeyMEJBHWOBZLFGSU-UHFFFAOYSA-N
XLogP2.09
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(4-ethylpiperazine-1-carbonyl)-5-phenyl-1,3-oxazolidin-2-one
CID 110689081
(5R,6S)-6-(4-methylpiperidine-1-carbonyl)-5-phenylmorpholin-3-one
CID 134704890
4-(3,4-dihydro-2H-quinoline-1-carbonyl)-5-phenyl-1,3-oxazolidin-2-one
CID 110689141
methyl (4S,5S)-2-oxo-5-phenyl-1,3-oxazolidine-4-carboxylate
CID 121224065
1-methyl-5-(4-methylpiperidine-1-carbonyl)-6-phenylpiperidin-2-one
CID 56730517
2-[(4R,5S)-2-oxo-5-phenyl-1,3-oxazolidin-4-yl]propanoic acid
CID 57373165
N-[4-[3-benzyl-4-(4-methylpiperidine-1-carbonyl)-2-oxo-1,3-oxazolidin-5-yl]phenyl]-2-methylpropanamide
CID 42840686
(4S,5R)-4-(hydroxymethyl)-5-phenyl-1,3-oxazolidin-2-one
CID 101245141
(4S,5S)-5-phenyl-4-propan-2-yl-1,3-oxazolidin-2-one
CID 70829759
4-methyl-N,N-diphenylpiperidine-1-carboxamide
CID 71122865
N-(4-fluorophenyl)-2-oxo-5-phenyl-1,3-oxazolidine-4-carboxamide
CID 110689144
4-methyl-N-(2-phenylcyclopropyl)piperidine-1-carboxamide
CID 60586425

Frequently Asked Questions

What is the IUPAC name of 4-(4-methylpiperidine-1-carbonyl)-5-phenyl-1,3-oxazolidin-2-one?
The IUPAC name of 4-(4-methylpiperidine-1-carbonyl)-5-phenyl-1,3-oxazolidin-2-one (CID 110689071) is 4-(4-methylpiperidine-1-carbonyl)-5-phenyl-1,3-oxazolidin-2-one.
What is the SMILES notation for 4-(4-methylpiperidine-1-carbonyl)-5-phenyl-1,3-oxazolidin-2-one?
The canonical SMILES for 4-(4-methylpiperidine-1-carbonyl)-5-phenyl-1,3-oxazolidin-2-one is CC1CCN(C(=O)C2NC(=O)OC2c2ccccc2)CC1.
What is the InChIKey of 4-(4-methylpiperidine-1-carbonyl)-5-phenyl-1,3-oxazolidin-2-one?
The InChIKey is MEJBHWOBZLFGSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O3/c1-11-7-9-18(10-8-11)15(19)13-14(21-16(20)17-13)12-5-3-2-4-6-12/h2-6,11,13-14H,7-10H2,1H3,(H,17,20).
What are the key properties of 4-(4-methylpiperidine-1-carbonyl)-5-phenyl-1,3-oxazolidin-2-one?
4-(4-methylpiperidine-1-carbonyl)-5-phenyl-1,3-oxazolidin-2-one has a molecular weight of 288.35 g/mol, XLogP of 2.09, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methylpiperidine-1-carbonyl)-5-phenyl-1,3-oxazolidin-2-one is sourced from PubChem (CID 110689071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).