2-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)amino]-1-morpholin-4-ylethanone

C11H16N4O3 — CID 86806563

IUPAC2-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)amino]-1-morpholin-4-ylethanone
SMILESO=C(CNc1nnc(C2CC2)o1)N1CCOCC1
InChIInChI=1S/C11H16N4O3/c16-9(15-3-5-17-6-4-15)7-12-11-14-13-10(18-11)8-1-2-8/h8H,1-7H2,(H,12,14)
InChIKeyLFDUTUYCTCTXNS-UHFFFAOYSA-N
MW252.27 g/mol
LogP0.22
Rot. Bonds4

About 2-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)amino]-1-morpholin-4-ylethanone

2-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)amino]-1-morpholin-4-ylethanone (PubChem CID 86806563) has the molecular formula C11H16N4O3 and a molecular weight of 252.27 g/mol. Its IUPAC name is 2-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)amino]-1-morpholin-4-ylethanone.

Molecular Properties

Compound Name2-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)amino]-1-morpholin-4-ylethanone
PubChem CID86806563
Molecular FormulaC11H16N4O3
Molecular Weight252.27 g/mol
Exact Mass252.12
IUPAC Name2-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)amino]-1-morpholin-4-ylethanone
SMILESO=C(CNc1nnc(C2CC2)o1)N1CCOCC1
InChIInChI=1S/C11H16N4O3/c16-9(15-3-5-17-6-4-15)7-12-11-14-13-10(18-11)8-1-2-8/h8H,1-7H2,(H,12,14)
InChIKeyLFDUTUYCTCTXNS-UHFFFAOYSA-N
XLogP0.22
TPSA80.49 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.27
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)amino]-1-morpholin-4-ylethanone?
The IUPAC name of 2-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)amino]-1-morpholin-4-ylethanone (CID 86806563) is 2-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)amino]-1-morpholin-4-ylethanone.
What is the SMILES notation for 2-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)amino]-1-morpholin-4-ylethanone?
The canonical SMILES for 2-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)amino]-1-morpholin-4-ylethanone is O=C(CNc1nnc(C2CC2)o1)N1CCOCC1.
What is the InChIKey of 2-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)amino]-1-morpholin-4-ylethanone?
The InChIKey is LFDUTUYCTCTXNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O3/c16-9(15-3-5-17-6-4-15)7-12-11-14-13-10(18-11)8-1-2-8/h8H,1-7H2,(H,12,14).
What are the key properties of 2-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)amino]-1-morpholin-4-ylethanone?
2-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)amino]-1-morpholin-4-ylethanone has a molecular weight of 252.27 g/mol, XLogP of 0.22, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)amino]-1-morpholin-4-ylethanone is sourced from PubChem (CID 86806563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).