(5R)-5-methyl-3-[[4-(1-piperidin-1-ylethyl)phenyl]methyl]-1,3-oxazolidin-2-one

C18H26N2O2 — CID 44591686

IUPAC(5R)-5-methyl-3-[[4-(1-piperidin-1-ylethyl)phenyl]methyl]-1,3-oxazolidin-2-one
SMILESCC(c1ccc(CN2C[C@@H](C)OC2=O)cc1)N1CCCCC1
InChIInChI=1S/C18H26N2O2/c1-14-12-20(18(21)22-14)13-16-6-8-17(9-7-16)15(2)19-10-4-3-5-11-19/h6-9,14-15H,3-5,10-13H2,1-2H3/t14-,15?/m1/s1
InChIKeyJQNPPGYUOXGPAM-GICMACPYSA-N
MW302.42 g/mol
LogP3.57
Rot. Bonds4

About (5R)-5-methyl-3-[[4-(1-piperidin-1-ylethyl)phenyl]methyl]-1,3-oxazolidin-2-one

(5R)-5-methyl-3-[[4-(1-piperidin-1-ylethyl)phenyl]methyl]-1,3-oxazolidin-2-one (PubChem CID 44591686) has the molecular formula C18H26N2O2 and a molecular weight of 302.42 g/mol. Its IUPAC name is (5R)-5-methyl-3-[[4-(1-piperidin-1-ylethyl)phenyl]methyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name(5R)-5-methyl-3-[[4-(1-piperidin-1-ylethyl)phenyl]methyl]-1,3-oxazolidin-2-one
PubChem CID44591686
Molecular FormulaC18H26N2O2
Molecular Weight302.42 g/mol
Exact Mass302.20
IUPAC Name(5R)-5-methyl-3-[[4-(1-piperidin-1-ylethyl)phenyl]methyl]-1,3-oxazolidin-2-one
SMILESCC(c1ccc(CN2C[C@@H](C)OC2=O)cc1)N1CCCCC1
InChIInChI=1S/C18H26N2O2/c1-14-12-20(18(21)22-14)13-16-6-8-17(9-7-16)15(2)19-10-4-3-5-11-19/h6-9,14-15H,3-5,10-13H2,1-2H3/t14-,15?/m1/s1
InChIKeyJQNPPGYUOXGPAM-GICMACPYSA-N
XLogP3.57
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 53.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze (5R)-5-methyl-3-[[4-(1-piperidin-1-ylethyl)phenyl]methyl]-1,3-oxazolidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (5R)-5-methyl-3-[[4-(1-piperidin-1-ylethyl)phenyl]methyl]-1,3-oxazolidin-2-one?
The IUPAC name of (5R)-5-methyl-3-[[4-(1-piperidin-1-ylethyl)phenyl]methyl]-1,3-oxazolidin-2-one (CID 44591686) is (5R)-5-methyl-3-[[4-(1-piperidin-1-ylethyl)phenyl]methyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for (5R)-5-methyl-3-[[4-(1-piperidin-1-ylethyl)phenyl]methyl]-1,3-oxazolidin-2-one?
The canonical SMILES for (5R)-5-methyl-3-[[4-(1-piperidin-1-ylethyl)phenyl]methyl]-1,3-oxazolidin-2-one is CC(c1ccc(CN2C[C@@H](C)OC2=O)cc1)N1CCCCC1.
What is the InChIKey of (5R)-5-methyl-3-[[4-(1-piperidin-1-ylethyl)phenyl]methyl]-1,3-oxazolidin-2-one?
The InChIKey is JQNPPGYUOXGPAM-GICMACPYSA-N. The full InChI is InChI=1S/C18H26N2O2/c1-14-12-20(18(21)22-14)13-16-6-8-17(9-7-16)15(2)19-10-4-3-5-11-19/h6-9,14-15H,3-5,10-13H2,1-2H3/t14-,15?/m1/s1.
What are the key properties of (5R)-5-methyl-3-[[4-(1-piperidin-1-ylethyl)phenyl]methyl]-1,3-oxazolidin-2-one?
(5R)-5-methyl-3-[[4-(1-piperidin-1-ylethyl)phenyl]methyl]-1,3-oxazolidin-2-one has a molecular weight of 302.42 g/mol, XLogP of 3.57, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-methyl-3-[[4-(1-piperidin-1-ylethyl)phenyl]methyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 44591686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).