1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]propan-1-one;cyclopropane

C19H30N4O2 — CID 171632459

IUPAC1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]propan-1-one;cyclopropane
SMILESC1CC1.CC(Nc1nnc(C2CCC2)o1)C(=O)N1CCC2(CC1)CC2
InChIInChI=1S/C16H24N4O2.C3H6/c1-11(14(21)20-9-7-16(5-6-16)8-10-20)17-15-19-18-13(22-15)12-3-2-4-12;1-2-3-1/h11-12H,2-10H2,1H3,(H,17,19);1-3H2
InChIKeyCTZXLQKHOSMYJA-UHFFFAOYSA-N
MW346.48 g/mol
LogP3.71
Rot. Bonds4

About 1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]propan-1-one;cyclopropane

1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]propan-1-one;cyclopropane (PubChem CID 171632459) has the molecular formula C19H30N4O2 and a molecular weight of 346.48 g/mol. Its IUPAC name is 1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]propan-1-one;cyclopropane.

Molecular Properties

Compound Name1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]propan-1-one;cyclopropane
PubChem CID171632459
Molecular FormulaC19H30N4O2
Molecular Weight346.48 g/mol
Exact Mass346.24
IUPAC Name1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]propan-1-one;cyclopropane
SMILESC1CC1.CC(Nc1nnc(C2CCC2)o1)C(=O)N1CCC2(CC1)CC2
InChIInChI=1S/C16H24N4O2.C3H6/c1-11(14(21)20-9-7-16(5-6-16)8-10-20)17-15-19-18-13(22-15)12-3-2-4-12;1-2-3-1/h11-12H,2-10H2,1H3,(H,17,19);1-3H2
InChIKeyCTZXLQKHOSMYJA-UHFFFAOYSA-N
XLogP3.71
TPSA71.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.48
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]propan-1-one;cyclopropane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]propan-1-one;cyclopropane?
The IUPAC name of 1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]propan-1-one;cyclopropane (CID 171632459) is 1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]propan-1-one;cyclopropane.
What is the SMILES notation for 1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]propan-1-one;cyclopropane?
The canonical SMILES for 1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]propan-1-one;cyclopropane is C1CC1.CC(Nc1nnc(C2CCC2)o1)C(=O)N1CCC2(CC1)CC2.
What is the InChIKey of 1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]propan-1-one;cyclopropane?
The InChIKey is CTZXLQKHOSMYJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O2.C3H6/c1-11(14(21)20-9-7-16(5-6-16)8-10-20)17-15-19-18-13(22-15)12-3-2-4-12;1-2-3-1/h11-12H,2-10H2,1H3,(H,17,19);1-3H2.
What are the key properties of 1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]propan-1-one;cyclopropane?
1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]propan-1-one;cyclopropane has a molecular weight of 346.48 g/mol, XLogP of 3.71, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]propan-1-one;cyclopropane is sourced from PubChem (CID 171632459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).