8-(2-morpholin-4-ylethoxy)-4-propan-2-yl-1,3-benzoxazin-2-one

C17H22N2O4 — CID 142239586

IUPAC8-(2-morpholin-4-ylethoxy)-4-propan-2-yl-1,3-benzoxazin-2-one
SMILESCC(C)c1nc(=O)oc2c(OCCN3CCOCC3)cccc12
InChIInChI=1S/C17H22N2O4/c1-12(2)15-13-4-3-5-14(16(13)23-17(20)18-15)22-11-8-19-6-9-21-10-7-19/h3-5,12H,6-11H2,1-2H3
InChIKeyRSNXBQVAMOHBRA-UHFFFAOYSA-N
MW318.37 g/mol
LogP2.02
Rot. Bonds5

About 8-(2-morpholin-4-ylethoxy)-4-propan-2-yl-1,3-benzoxazin-2-one

8-(2-morpholin-4-ylethoxy)-4-propan-2-yl-1,3-benzoxazin-2-one (PubChem CID 142239586) has the molecular formula C17H22N2O4 and a molecular weight of 318.37 g/mol. Its IUPAC name is 8-(2-morpholin-4-ylethoxy)-4-propan-2-yl-1,3-benzoxazin-2-one.

Molecular Properties

Compound Name8-(2-morpholin-4-ylethoxy)-4-propan-2-yl-1,3-benzoxazin-2-one
PubChem CID142239586
Molecular FormulaC17H22N2O4
Molecular Weight318.37 g/mol
Exact Mass318.16
IUPAC Name8-(2-morpholin-4-ylethoxy)-4-propan-2-yl-1,3-benzoxazin-2-one
SMILESCC(C)c1nc(=O)oc2c(OCCN3CCOCC3)cccc12
InChIInChI=1S/C17H22N2O4/c1-12(2)15-13-4-3-5-14(16(13)23-17(20)18-15)22-11-8-19-6-9-21-10-7-19/h3-5,12H,6-11H2,1-2H3
InChIKeyRSNXBQVAMOHBRA-UHFFFAOYSA-N
XLogP2.02
TPSA64.80 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.37
LogP ≤ 52.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-methyl-5-(2-morpholin-4-ylethoxy)isoquinolin-1-one
CID 20645387
2-methyl-1-[2-(2-morpholin-4-ylethoxy)phenyl]propan-1-one
CID 118041363
(1S)-1-[2-(2-morpholin-4-ylethoxy)phenyl]ethanamine
CID 78936484
4-(2-morpholin-4-ylethoxy)chromen-2-one
CID 171354921
ethane;4-[2-(2-methylphenoxy)ethyl]morpholine
CID 144752549
4-ethoxy-5-(2-morpholin-4-ylethoxy)fluoren-9-one
CID 19594681
4-[2-(4-chloronaphthalen-1-yl)oxyethyl]morpholine
CID 868523
4-[2-(5-phenyl-2-propan-2-ylphenoxy)ethyl]morpholine
CID 146386321
methyl 2-chloro-2-oxoacetate;methyl 2-[4-(2-morpholin-4-ylethoxy)naphthalen-1-yl]-2-oxoacetate;4-(2-naphthalen-1-yloxyethyl)morpholine
CID 159215074
1-[4-(2-morpholin-4-ylethoxy)naphthalen-1-yl]propane-1,2-dione
CID 58262575
N,N-dimethyl-2-(2-morpholin-4-ylethoxy)aniline
CID 147491623
[4-(2-morpholin-4-ylethoxy)naphthalen-1-yl] cyanate
CID 143015562

Frequently Asked Questions

What is the IUPAC name of 8-(2-morpholin-4-ylethoxy)-4-propan-2-yl-1,3-benzoxazin-2-one?
The IUPAC name of 8-(2-morpholin-4-ylethoxy)-4-propan-2-yl-1,3-benzoxazin-2-one (CID 142239586) is 8-(2-morpholin-4-ylethoxy)-4-propan-2-yl-1,3-benzoxazin-2-one.
What is the SMILES notation for 8-(2-morpholin-4-ylethoxy)-4-propan-2-yl-1,3-benzoxazin-2-one?
The canonical SMILES for 8-(2-morpholin-4-ylethoxy)-4-propan-2-yl-1,3-benzoxazin-2-one is CC(C)c1nc(=O)oc2c(OCCN3CCOCC3)cccc12.
What is the InChIKey of 8-(2-morpholin-4-ylethoxy)-4-propan-2-yl-1,3-benzoxazin-2-one?
The InChIKey is RSNXBQVAMOHBRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O4/c1-12(2)15-13-4-3-5-14(16(13)23-17(20)18-15)22-11-8-19-6-9-21-10-7-19/h3-5,12H,6-11H2,1-2H3.
What are the key properties of 8-(2-morpholin-4-ylethoxy)-4-propan-2-yl-1,3-benzoxazin-2-one?
8-(2-morpholin-4-ylethoxy)-4-propan-2-yl-1,3-benzoxazin-2-one has a molecular weight of 318.37 g/mol, XLogP of 2.02, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2-morpholin-4-ylethoxy)-4-propan-2-yl-1,3-benzoxazin-2-one is sourced from PubChem (CID 142239586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).