N-[4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]morpholine-3-carboxamide;hydrochloride

C17H21ClN4O4 — CID 119783651

About N-[4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]morpholine-3-carboxamide;hydrochloride

N-[4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]morpholine-3-carboxamide;hydrochloride (PubChem CID 119783651) has the molecular formula C17H21ClN4O4 and a molecular weight of 380.83 g/mol. Its IUPAC name is N-[4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]morpholine-3-carboxamide;hydrochloride.

Molecular Properties

• Compound Name: N-[4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]morpholine-3-carboxamide;hydrochloride
• PubChem CID: 119783651
• Molecular Formula: C17H21ClN4O4
• Molecular Weight: 380.83 g/mol
• Exact Mass: 380.13
• IUPAC Name: N-[4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]morpholine-3-carboxamide;hydrochloride
• SMILES: Cl.O=C(Nc1ccc(OCc2noc(C3CC3)n2)cc1)C1COCCN1
• InChI: InChI=1S/C17H20N4O4.ClH/c22-16(14-9-23-8-7-18-14)19-12-3-5-13(6-4-12)24-10-15-20-17(25-21-15)11-1-2-11;/h3-6,11,14,18H,1-2,7-10H2,(H,19,22);1H
• InChIKey: SNLNMJNQNNFSEU-UHFFFAOYSA-N
• XLogP: 1.87
• TPSA: 98.51 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 7
• Rotatable Bonds: 6
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	380.83
LogP ≤ 5	1.87
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of N-[4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]morpholine-3-carboxamide;hydrochloride?

The IUPAC name of N-[4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]morpholine-3-carboxamide;hydrochloride (CID 119783651) is N-[4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]morpholine-3-carboxamide;hydrochloride.

What is the SMILES notation for N-[4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]morpholine-3-carboxamide;hydrochloride?

The canonical SMILES for N-[4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]morpholine-3-carboxamide;hydrochloride is Cl.O=C(Nc1ccc(OCc2noc(C3CC3)n2)cc1)C1COCCN1.

What is the InChIKey of N-[4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]morpholine-3-carboxamide;hydrochloride?

The InChIKey is SNLNMJNQNNFSEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O4.ClH/c22-16(14-9-23-8-7-18-14)19-12-3-5-13(6-4-12)24-10-15-20-17(25-21-15)11-1-2-11;/h3-6,11,14,18H,1-2,7-10H2,(H,19,22);1H.

What are the key properties of N-[4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]morpholine-3-carboxamide;hydrochloride?

N-[4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]morpholine-3-carboxamide;hydrochloride has a molecular weight of 380.83 g/mol, XLogP of 1.87, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]morpholine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119783651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).