3-[3-(pyridin-3-ylmethylamino)phenyl]-1,3-oxazolidin-2-one

C15H15N3O2 — CID 43727252

IUPAC3-[3-(pyridin-3-ylmethylamino)phenyl]-1,3-oxazolidin-2-one
SMILESO=C1OCCN1c1cccc(NCc2cccnc2)c1
InChIInChI=1S/C15H15N3O2/c19-15-18(7-8-20-15)14-5-1-4-13(9-14)17-11-12-3-2-6-16-10-12/h1-6,9-10,17H,7-8,11H2
InChIKeySNQVHTJKPYHYJZ-UHFFFAOYSA-N
MW269.30 g/mol
LogP2.65
Rot. Bonds4

About 3-[3-(pyridin-3-ylmethylamino)phenyl]-1,3-oxazolidin-2-one

3-[3-(pyridin-3-ylmethylamino)phenyl]-1,3-oxazolidin-2-one (PubChem CID 43727252) has the molecular formula C15H15N3O2 and a molecular weight of 269.30 g/mol. Its IUPAC name is 3-[3-(pyridin-3-ylmethylamino)phenyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-[3-(pyridin-3-ylmethylamino)phenyl]-1,3-oxazolidin-2-one
PubChem CID43727252
Molecular FormulaC15H15N3O2
Molecular Weight269.30 g/mol
Exact Mass269.12
IUPAC Name3-[3-(pyridin-3-ylmethylamino)phenyl]-1,3-oxazolidin-2-one
SMILESO=C1OCCN1c1cccc(NCc2cccnc2)c1
InChIInChI=1S/C15H15N3O2/c19-15-18(7-8-20-15)14-5-1-4-13(9-14)17-11-12-3-2-6-16-10-12/h1-6,9-10,17H,7-8,11H2
InChIKeySNQVHTJKPYHYJZ-UHFFFAOYSA-N
XLogP2.65
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[3-[(1-ethylpyrrol-3-yl)methylamino]phenyl]-1,3-oxazolidin-2-one
CID 66414553
3-[3-[(6-bromo-2-pyridinyl)methylamino]phenyl]-1,3-oxazolidin-2-one
CID 115938027
N-(pyridin-3-ylmethyl)-3-pyrrol-1-ylaniline
CID 43732990
3-[3-[(5-methylfuran-2-yl)methylamino]phenyl]-1,3-oxazolidin-2-one
CID 43727255
3-[3-[(4-bromothiophen-2-yl)methylamino]phenyl]-1,3-oxazolidin-2-one
CID 43727311
3-[3-[2-(tert-butylamino)ethylamino]phenyl]-1,3-oxazolidin-2-one
CID 107445145
N-[1-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]ethyl]-3-pyridin-3-ylpropanamide
CID 48822167
N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-2-phenylacetamide
CID 110874037
N-[[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]methyl]-2-pyridin-3-ylquinoline-4-carboxamide
CID 55815215
N-(pyridin-3-ylmethyl)pyridin-3-amine
CID 13304847
3-[3-(piperidin-4-ylmethylamino)phenyl]-1,3-oxazolidin-2-one
CID 79708178
2-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]acetaldehyde
CID 57444342

Frequently Asked Questions

What is the IUPAC name of 3-[3-(pyridin-3-ylmethylamino)phenyl]-1,3-oxazolidin-2-one?
The IUPAC name of 3-[3-(pyridin-3-ylmethylamino)phenyl]-1,3-oxazolidin-2-one (CID 43727252) is 3-[3-(pyridin-3-ylmethylamino)phenyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-[3-(pyridin-3-ylmethylamino)phenyl]-1,3-oxazolidin-2-one?
The canonical SMILES for 3-[3-(pyridin-3-ylmethylamino)phenyl]-1,3-oxazolidin-2-one is O=C1OCCN1c1cccc(NCc2cccnc2)c1.
What is the InChIKey of 3-[3-(pyridin-3-ylmethylamino)phenyl]-1,3-oxazolidin-2-one?
The InChIKey is SNQVHTJKPYHYJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O2/c19-15-18(7-8-20-15)14-5-1-4-13(9-14)17-11-12-3-2-6-16-10-12/h1-6,9-10,17H,7-8,11H2.
What are the key properties of 3-[3-(pyridin-3-ylmethylamino)phenyl]-1,3-oxazolidin-2-one?
3-[3-(pyridin-3-ylmethylamino)phenyl]-1,3-oxazolidin-2-one has a molecular weight of 269.30 g/mol, XLogP of 2.65, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(pyridin-3-ylmethylamino)phenyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 43727252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).