3-[2-[(7-fluoroquinazolin-4-yl)amino]ethyl]-1,3-oxazolidin-2-one

C13H13FN4O2 — CID 72849237

IUPAC3-[2-[(7-fluoroquinazolin-4-yl)amino]ethyl]-1,3-oxazolidin-2-one
SMILESO=C1OCCN1CCNc1ncnc2cc(F)ccc12
InChIInChI=1S/C13H13FN4O2/c14-9-1-2-10-11(7-9)16-8-17-12(10)15-3-4-18-5-6-20-13(18)19/h1-2,7-8H,3-6H2,(H,15,16,17)
InChIKeyFERGFLLIMUWNSV-UHFFFAOYSA-N
MW276.27 g/mol
LogP1.63
Rot. Bonds4

About 3-[2-[(7-fluoroquinazolin-4-yl)amino]ethyl]-1,3-oxazolidin-2-one

3-[2-[(7-fluoroquinazolin-4-yl)amino]ethyl]-1,3-oxazolidin-2-one (PubChem CID 72849237) has the molecular formula C13H13FN4O2 and a molecular weight of 276.27 g/mol. Its IUPAC name is 3-[2-[(7-fluoroquinazolin-4-yl)amino]ethyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-[2-[(7-fluoroquinazolin-4-yl)amino]ethyl]-1,3-oxazolidin-2-one
PubChem CID72849237
Molecular FormulaC13H13FN4O2
Molecular Weight276.27 g/mol
Exact Mass276.10
IUPAC Name3-[2-[(7-fluoroquinazolin-4-yl)amino]ethyl]-1,3-oxazolidin-2-one
SMILESO=C1OCCN1CCNc1ncnc2cc(F)ccc12
InChIInChI=1S/C13H13FN4O2/c14-9-1-2-10-11(7-9)16-8-17-12(10)15-3-4-18-5-6-20-13(18)19/h1-2,7-8H,3-6H2,(H,15,16,17)
InChIKeyFERGFLLIMUWNSV-UHFFFAOYSA-N
XLogP1.63
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.27
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-[2-[(7-fluoroquinazolin-4-yl)amino]ethyl]-1,3-oxazolidin-2-one with MolForge

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Related Compounds

(Quinazolin-4-ylamino)acetic acid
CID 718838
N-(2-methoxyethyl)quinazolin-4-amine
CID 1563320
(4R)-3-[2-[[(1S)-1-(7-fluoro-4,5-dihydroimidazo[1,5-a]quinolin-3-yl)ethyl]amino]pyrimidin-4-yl]-4-[(1S)-1-fluoroethyl]-1,3-oxazolidin-2-one
CID 155553562
N1,N1-dimethyl-N2-4-quinazolinyl-1,2-ethanediamine
CID 18753
ethyl 4-(8-fluoro-5H-pyrimido[5,4-b]indol-4-yl)piperazine-1-carboxylate
CID 919665
2-N-(4-fluorophenyl)-4-N-(2-pyrrolidin-1-ylethyl)quinazoline-2,4-diamine
CID 137651712
2-N-(4-fluorophenyl)-4-N-(2-morpholin-4-ylethyl)quinazoline-2,4-diamine
CID 137657146
Methyl 4-[4-[(6-methylquinazolin-4-yl)amino]cyclohexyl]piperazine-1-carboxylate
CID 155535119
1-(2-Hydroxyethyl)-3-(4-morpholin-4-ylquinazolin-2-yl)urea
CID 162653472
1-Methyl-3-(4-morpholin-4-ylquinazolin-2-yl)urea
CID 162658341
N-[1-[4-(2-oxo-1,3-oxazolidin-4-yl)cyclohexyl]azetidin-3-yl]-2-[[6-(trifluoromethyl)quinazolin-4-yl]amino]acetamide
CID 54770173
3-[5-Fluoro-2-[1-[5-(4-fluoro-3-methylphenyl)-2-pyridinyl]ethylamino]pyrimidin-4-yl]-1,3-oxazolidin-2-one
CID 71541905

Frequently Asked Questions

What is the IUPAC name of 3-[2-[(7-fluoroquinazolin-4-yl)amino]ethyl]-1,3-oxazolidin-2-one?
The IUPAC name of 3-[2-[(7-fluoroquinazolin-4-yl)amino]ethyl]-1,3-oxazolidin-2-one (CID 72849237) is 3-[2-[(7-fluoroquinazolin-4-yl)amino]ethyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-[2-[(7-fluoroquinazolin-4-yl)amino]ethyl]-1,3-oxazolidin-2-one?
The canonical SMILES for 3-[2-[(7-fluoroquinazolin-4-yl)amino]ethyl]-1,3-oxazolidin-2-one is O=C1OCCN1CCNc1ncnc2cc(F)ccc12.
What is the InChIKey of 3-[2-[(7-fluoroquinazolin-4-yl)amino]ethyl]-1,3-oxazolidin-2-one?
The InChIKey is FERGFLLIMUWNSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13FN4O2/c14-9-1-2-10-11(7-9)16-8-17-12(10)15-3-4-18-5-6-20-13(18)19/h1-2,7-8H,3-6H2,(H,15,16,17).
What are the key properties of 3-[2-[(7-fluoroquinazolin-4-yl)amino]ethyl]-1,3-oxazolidin-2-one?
3-[2-[(7-fluoroquinazolin-4-yl)amino]ethyl]-1,3-oxazolidin-2-one has a molecular weight of 276.27 g/mol, XLogP of 1.63, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-[(7-fluoroquinazolin-4-yl)amino]ethyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 72849237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).