1-(3-morpholin-4-ylpropyl)-[1,3]oxazolo[5,4-b]pyridin-2-one

C13H17N3O3 — CID 10084115

IUPAC1-(3-morpholin-4-ylpropyl)-[1,3]oxazolo[5,4-b]pyridin-2-one
SMILESO=c1oc2ncccc2n1CCCN1CCOCC1
InChIInChI=1S/C13H17N3O3/c17-13-16(11-3-1-4-14-12(11)19-13)6-2-5-15-7-9-18-10-8-15/h1,3-4H,2,5-10H2
InChIKeyBXAZGHKDWKIAJP-UHFFFAOYSA-N
MW263.30 g/mol
LogP0.71
Rot. Bonds4

About 1-(3-morpholin-4-ylpropyl)-[1,3]oxazolo[5,4-b]pyridin-2-one

1-(3-morpholin-4-ylpropyl)-[1,3]oxazolo[5,4-b]pyridin-2-one (PubChem CID 10084115) has the molecular formula C13H17N3O3 and a molecular weight of 263.30 g/mol. Its IUPAC name is 1-(3-morpholin-4-ylpropyl)-[1,3]oxazolo[5,4-b]pyridin-2-one.

Molecular Properties

Compound Name1-(3-morpholin-4-ylpropyl)-[1,3]oxazolo[5,4-b]pyridin-2-one
PubChem CID10084115
Molecular FormulaC13H17N3O3
Molecular Weight263.30 g/mol
Exact Mass263.13
IUPAC Name1-(3-morpholin-4-ylpropyl)-[1,3]oxazolo[5,4-b]pyridin-2-one
SMILESO=c1oc2ncccc2n1CCCN1CCOCC1
InChIInChI=1S/C13H17N3O3/c17-13-16(11-3-1-4-14-12(11)19-13)6-2-5-15-7-9-18-10-8-15/h1,3-4H,2,5-10H2
InChIKeyBXAZGHKDWKIAJP-UHFFFAOYSA-N
XLogP0.71
TPSA60.50 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 50.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

1-(2-morpholin-4-ylethyl)-[1,3]oxazolo[5,4-b]pyridin-2-one
CID 10037683
1-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]-[1,3]oxazolo[5,4-b]pyridin-2-one
CID 3074813
1-[2-(4-naphthalen-1-ylpiperazin-1-yl)ethyl]-[1,3]oxazolo[5,4-b]pyridin-2-one
CID 10429498
3-(2-morpholin-4-ylethyl)-[1,3]oxazolo[4,5-b]pyridin-2-one
CID 3072034
1-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-[1,3]oxazolo[5,4-b]pyridin-2-one
CID 10066711
10-(2-morpholin-4-ylethyl)benzo[b][1,8]naphthyridin-5-one
CID 10267337
3-[5-[4-[2-(2-oxo-1,3-benzoxazol-3-yl)ethyl]piperazin-1-yl]pentyl]-1,3-benzoxazol-2-one
CID 58511876
N-(4-morpholin-4-ylbutyl)-4-(2-oxo-1,3-benzoxazol-3-yl)butanamide
CID 47041811
3-[3-(4-pentylpiperazin-1-yl)propyl]-[1,3]oxazolo[4,5-b]pyridin-2-one
CID 67898464
4-(3-pyrimidin-2-ylpropyl)morpholine
CID 170871392
4-[3-(3-bromo-2-pyridinyl)propyl]morpholine
CID 170871440
8-(2-hydroxyanilino)-1-(3-morpholin-4-ylpropyl)-[1,3]oxazolo[4,5-g]quinazolin-2-one
CID 70682361

Frequently Asked Questions

What is the IUPAC name of 1-(3-morpholin-4-ylpropyl)-[1,3]oxazolo[5,4-b]pyridin-2-one?
The IUPAC name of 1-(3-morpholin-4-ylpropyl)-[1,3]oxazolo[5,4-b]pyridin-2-one (CID 10084115) is 1-(3-morpholin-4-ylpropyl)-[1,3]oxazolo[5,4-b]pyridin-2-one.
What is the SMILES notation for 1-(3-morpholin-4-ylpropyl)-[1,3]oxazolo[5,4-b]pyridin-2-one?
The canonical SMILES for 1-(3-morpholin-4-ylpropyl)-[1,3]oxazolo[5,4-b]pyridin-2-one is O=c1oc2ncccc2n1CCCN1CCOCC1.
What is the InChIKey of 1-(3-morpholin-4-ylpropyl)-[1,3]oxazolo[5,4-b]pyridin-2-one?
The InChIKey is BXAZGHKDWKIAJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O3/c17-13-16(11-3-1-4-14-12(11)19-13)6-2-5-15-7-9-18-10-8-15/h1,3-4H,2,5-10H2.
What are the key properties of 1-(3-morpholin-4-ylpropyl)-[1,3]oxazolo[5,4-b]pyridin-2-one?
1-(3-morpholin-4-ylpropyl)-[1,3]oxazolo[5,4-b]pyridin-2-one has a molecular weight of 263.30 g/mol, XLogP of 0.71, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-morpholin-4-ylpropyl)-[1,3]oxazolo[5,4-b]pyridin-2-one is sourced from PubChem (CID 10084115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).