3-[methyl(2-morpholin-4-ylethyl)amino]-1,2-benzoxazol-5-ol

C14H19N3O3 — CID 18796459

IUPAC3-[methyl(2-morpholin-4-ylethyl)amino]-1,2-benzoxazol-5-ol
SMILESCN(CCN1CCOCC1)c1noc2ccc(O)cc12
InChIInChI=1S/C14H19N3O3/c1-16(4-5-17-6-8-19-9-7-17)14-12-10-11(18)2-3-13(12)20-15-14/h2-3,10,18H,4-9H2,1H3
InChIKeyFZIGPIVBORXDTB-UHFFFAOYSA-N
MW277.32 g/mol
LogP1.30
Rot. Bonds4

About 3-[methyl(2-morpholin-4-ylethyl)amino]-1,2-benzoxazol-5-ol

3-[methyl(2-morpholin-4-ylethyl)amino]-1,2-benzoxazol-5-ol (PubChem CID 18796459) has the molecular formula C14H19N3O3 and a molecular weight of 277.32 g/mol. Its IUPAC name is 3-[methyl(2-morpholin-4-ylethyl)amino]-1,2-benzoxazol-5-ol.

Molecular Properties

Compound Name3-[methyl(2-morpholin-4-ylethyl)amino]-1,2-benzoxazol-5-ol
PubChem CID18796459
Molecular FormulaC14H19N3O3
Molecular Weight277.32 g/mol
Exact Mass277.14
IUPAC Name3-[methyl(2-morpholin-4-ylethyl)amino]-1,2-benzoxazol-5-ol
SMILESCN(CCN1CCOCC1)c1noc2ccc(O)cc12
InChIInChI=1S/C14H19N3O3/c1-16(4-5-17-6-8-19-9-7-17)14-12-10-11(18)2-3-13(12)20-15-14/h2-3,10,18H,4-9H2,1H3
InChIKeyFZIGPIVBORXDTB-UHFFFAOYSA-N
XLogP1.30
TPSA61.97 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.32
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-methyl-N-(2-morpholin-4-ylethyl)-1,2-benzothiazol-3-amine
CID 54360291
N-methyl-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine
CID 123906232
(Z)-2-(5-hydroxy-1,2-benzoxazol-3-yl)-3-[2-(2-morpholin-4-ylethoxy)phenyl]prop-2-enenitrile
CID 12793471
4-tert-butyl-N-methyl-N-(2-morpholin-4-ylethyl)aniline
CID 158025581
2-N-methyl-2-N-(2-morpholin-4-ylethyl)pyridine-2,5-diamine
CID 59225426
2-N,2-N,4-N-trimethyl-4-N-(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine
CID 75422017
2-[1-(2-morpholin-4-ylethylamino)ethyl]benzene-1,4-diol
CID 43195502
5-ethyl-N-methyl-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine
CID 72890839
3-(bromomethyl)-1,2-benzoxazol-5-ol
CID 119090322
3-(2-morpholin-4-ylethyl)phenol
CID 82187913
N-methyl-N-(2-morpholin-4-ylethyl)-3-nitroaniline
CID 173013317
N-benzhydryl-N-methyl-2-morpholin-4-ylethanamine;hydrochloride
CID 54600904

Frequently Asked Questions

What is the IUPAC name of 3-[methyl(2-morpholin-4-ylethyl)amino]-1,2-benzoxazol-5-ol?
The IUPAC name of 3-[methyl(2-morpholin-4-ylethyl)amino]-1,2-benzoxazol-5-ol (CID 18796459) is 3-[methyl(2-morpholin-4-ylethyl)amino]-1,2-benzoxazol-5-ol.
What is the SMILES notation for 3-[methyl(2-morpholin-4-ylethyl)amino]-1,2-benzoxazol-5-ol?
The canonical SMILES for 3-[methyl(2-morpholin-4-ylethyl)amino]-1,2-benzoxazol-5-ol is CN(CCN1CCOCC1)c1noc2ccc(O)cc12.
What is the InChIKey of 3-[methyl(2-morpholin-4-ylethyl)amino]-1,2-benzoxazol-5-ol?
The InChIKey is FZIGPIVBORXDTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O3/c1-16(4-5-17-6-8-19-9-7-17)14-12-10-11(18)2-3-13(12)20-15-14/h2-3,10,18H,4-9H2,1H3.
What are the key properties of 3-[methyl(2-morpholin-4-ylethyl)amino]-1,2-benzoxazol-5-ol?
3-[methyl(2-morpholin-4-ylethyl)amino]-1,2-benzoxazol-5-ol has a molecular weight of 277.32 g/mol, XLogP of 1.30, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[methyl(2-morpholin-4-ylethyl)amino]-1,2-benzoxazol-5-ol is sourced from PubChem (CID 18796459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).