(5S)-5-[[methyl(2-methylpropyl)amino]methyl]-3-(4-methylpentyl)-1,3-oxazolidin-2-one

C15H30N2O2 — CID 138727162

IUPAC(5S)-5-[[methyl(2-methylpropyl)amino]methyl]-3-(4-methylpentyl)-1,3-oxazolidin-2-one
SMILESCC(C)CCCN1C[C@H](CN(C)CC(C)C)OC1=O
InChIInChI=1S/C15H30N2O2/c1-12(2)7-6-8-17-11-14(19-15(17)18)10-16(5)9-13(3)4/h12-14H,6-11H2,1-5H3/t14-/m0/s1
InChIKeyOFNVQPDKWATIFA-AWEZNQCLSA-N
MW270.42 g/mol
LogP2.83
Rot. Bonds8

About (5S)-5-[[methyl(2-methylpropyl)amino]methyl]-3-(4-methylpentyl)-1,3-oxazolidin-2-one

(5S)-5-[[methyl(2-methylpropyl)amino]methyl]-3-(4-methylpentyl)-1,3-oxazolidin-2-one (PubChem CID 138727162) has the molecular formula C15H30N2O2 and a molecular weight of 270.42 g/mol. Its IUPAC name is (5S)-5-[[methyl(2-methylpropyl)amino]methyl]-3-(4-methylpentyl)-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name(5S)-5-[[methyl(2-methylpropyl)amino]methyl]-3-(4-methylpentyl)-1,3-oxazolidin-2-one
PubChem CID138727162
Molecular FormulaC15H30N2O2
Molecular Weight270.42 g/mol
Exact Mass270.23
IUPAC Name(5S)-5-[[methyl(2-methylpropyl)amino]methyl]-3-(4-methylpentyl)-1,3-oxazolidin-2-one
SMILESCC(C)CCCN1C[C@H](CN(C)CC(C)C)OC1=O
InChIInChI=1S/C15H30N2O2/c1-12(2)7-6-8-17-11-14(19-15(17)18)10-16(5)9-13(3)4/h12-14H,6-11H2,1-5H3/t14-/m0/s1
InChIKeyOFNVQPDKWATIFA-AWEZNQCLSA-N
XLogP2.83
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (5S)-5-[[methyl(2-methylpropyl)amino]methyl]-3-(4-methylpentyl)-1,3-oxazolidin-2-one?
The IUPAC name of (5S)-5-[[methyl(2-methylpropyl)amino]methyl]-3-(4-methylpentyl)-1,3-oxazolidin-2-one (CID 138727162) is (5S)-5-[[methyl(2-methylpropyl)amino]methyl]-3-(4-methylpentyl)-1,3-oxazolidin-2-one.
What is the SMILES notation for (5S)-5-[[methyl(2-methylpropyl)amino]methyl]-3-(4-methylpentyl)-1,3-oxazolidin-2-one?
The canonical SMILES for (5S)-5-[[methyl(2-methylpropyl)amino]methyl]-3-(4-methylpentyl)-1,3-oxazolidin-2-one is CC(C)CCCN1C[C@H](CN(C)CC(C)C)OC1=O.
What is the InChIKey of (5S)-5-[[methyl(2-methylpropyl)amino]methyl]-3-(4-methylpentyl)-1,3-oxazolidin-2-one?
The InChIKey is OFNVQPDKWATIFA-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H30N2O2/c1-12(2)7-6-8-17-11-14(19-15(17)18)10-16(5)9-13(3)4/h12-14H,6-11H2,1-5H3/t14-/m0/s1.
What are the key properties of (5S)-5-[[methyl(2-methylpropyl)amino]methyl]-3-(4-methylpentyl)-1,3-oxazolidin-2-one?
(5S)-5-[[methyl(2-methylpropyl)amino]methyl]-3-(4-methylpentyl)-1,3-oxazolidin-2-one has a molecular weight of 270.42 g/mol, XLogP of 2.83, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-5-[[methyl(2-methylpropyl)amino]methyl]-3-(4-methylpentyl)-1,3-oxazolidin-2-one is sourced from PubChem (CID 138727162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).