5-(6-morpholin-4-yl-1,5-naphthyridin-3-yl)-1,3-benzoxazol-2-amine

C19H17N5O2 — CID 54675302

IUPAC5-(6-morpholin-4-yl-1,5-naphthyridin-3-yl)-1,3-benzoxazol-2-amine
SMILESNc1nc2cc(-c3cnc4ccc(N5CCOCC5)nc4c3)ccc2o1
InChIInChI=1S/C19H17N5O2/c20-19-23-16-9-12(1-3-17(16)26-19)13-10-15-14(21-11-13)2-4-18(22-15)24-5-7-25-8-6-24/h1-4,9-11H,5-8H2,(H2,20,23)
InChIKeyAHFRRKNLYYOBMB-UHFFFAOYSA-N
MW347.38 g/mol
LogP2.86
Rot. Bonds2

About 5-(6-morpholin-4-yl-1,5-naphthyridin-3-yl)-1,3-benzoxazol-2-amine

5-(6-morpholin-4-yl-1,5-naphthyridin-3-yl)-1,3-benzoxazol-2-amine (PubChem CID 54675302) has the molecular formula C19H17N5O2 and a molecular weight of 347.38 g/mol. Its IUPAC name is 5-(6-morpholin-4-yl-1,5-naphthyridin-3-yl)-1,3-benzoxazol-2-amine.

Molecular Properties

Compound Name5-(6-morpholin-4-yl-1,5-naphthyridin-3-yl)-1,3-benzoxazol-2-amine
PubChem CID54675302
Molecular FormulaC19H17N5O2
Molecular Weight347.38 g/mol
Exact Mass347.14
IUPAC Name5-(6-morpholin-4-yl-1,5-naphthyridin-3-yl)-1,3-benzoxazol-2-amine
SMILESNc1nc2cc(-c3cnc4ccc(N5CCOCC5)nc4c3)ccc2o1
InChIInChI=1S/C19H17N5O2/c20-19-23-16-9-12(1-3-17(16)26-19)13-10-15-14(21-11-13)2-4-18(22-15)24-5-7-25-8-6-24/h1-4,9-11H,5-8H2,(H2,20,23)
InChIKeyAHFRRKNLYYOBMB-UHFFFAOYSA-N
XLogP2.86
TPSA90.30 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.38
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

5-[3-(3-methylazetidin-1-yl)quinoxalin-6-yl]-1,3-benzoxazol-2-amine
CID 144716966
5-[3-(4-pyrazol-1-ylpiperidin-1-yl)quinoxalin-6-yl]-1,3-benzoxazol-2-amine
CID 70798763
5-[3-(3-pyrrolidin-1-ylazetidin-1-yl)quinoxalin-6-yl]-1,3-benzoxazol-2-amine
CID 70798676
(3S)-1-[7-(2-amino-1,3-benzoxazol-5-yl)quinoxalin-2-yl]pyrrolidin-3-ol
CID 70798709
[1-[7-(2-amino-1,3-benzoxazol-5-yl)quinoxalin-2-yl]azetidin-3-yl]-pyrrolidin-1-ylmethanone
CID 144716980
2-methyl-4-(3-morpholin-4-ylquinoxalin-6-yl)aniline
CID 67035841
2-(dimethylamino)acetaldehyde;5-[3-(4-methylpiperazin-1-yl)quinoxalin-6-yl]-1,3-benzoxazol-2-amine
CID 144716901
[4-[7-(2-amino-1,3-benzoxazol-5-yl)quinoxalin-2-yl]piperazin-1-yl]-[(2S)-pyrrolidin-2-yl]methanone
CID 70798675
5-[3-[3-(4,4-dihydroxypiperazin-4-ium-1-yl)azetidin-1-yl]quinoxalin-6-yl]-1,3-benzoxazol-2-amine
CID 123394826
4-[7-(3,5-difluorophenyl)quinoxalin-2-yl]morpholine
CID 67035153
4-(3-morpholin-4-ylquinoxalin-6-yl)benzamide
CID 67036137
5-[2-amino-3-(3-morpholin-4-ylazetidin-1-yl)quinoxalin-6-yl]-1,3-benzoxazol-2-amine
CID 70798491

Frequently Asked Questions

What is the IUPAC name of 5-(6-morpholin-4-yl-1,5-naphthyridin-3-yl)-1,3-benzoxazol-2-amine?
The IUPAC name of 5-(6-morpholin-4-yl-1,5-naphthyridin-3-yl)-1,3-benzoxazol-2-amine (CID 54675302) is 5-(6-morpholin-4-yl-1,5-naphthyridin-3-yl)-1,3-benzoxazol-2-amine.
What is the SMILES notation for 5-(6-morpholin-4-yl-1,5-naphthyridin-3-yl)-1,3-benzoxazol-2-amine?
The canonical SMILES for 5-(6-morpholin-4-yl-1,5-naphthyridin-3-yl)-1,3-benzoxazol-2-amine is Nc1nc2cc(-c3cnc4ccc(N5CCOCC5)nc4c3)ccc2o1.
What is the InChIKey of 5-(6-morpholin-4-yl-1,5-naphthyridin-3-yl)-1,3-benzoxazol-2-amine?
The InChIKey is AHFRRKNLYYOBMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N5O2/c20-19-23-16-9-12(1-3-17(16)26-19)13-10-15-14(21-11-13)2-4-18(22-15)24-5-7-25-8-6-24/h1-4,9-11H,5-8H2,(H2,20,23).
What are the key properties of 5-(6-morpholin-4-yl-1,5-naphthyridin-3-yl)-1,3-benzoxazol-2-amine?
5-(6-morpholin-4-yl-1,5-naphthyridin-3-yl)-1,3-benzoxazol-2-amine has a molecular weight of 347.38 g/mol, XLogP of 2.86, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6-morpholin-4-yl-1,5-naphthyridin-3-yl)-1,3-benzoxazol-2-amine is sourced from PubChem (CID 54675302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).