N-cyclopropyl-5-propan-2-yl-1,3,4-oxadiazol-2-amine;molecular hydrogen

C8H15N3O — CID 169163463

IUPACN-cyclopropyl-5-propan-2-yl-1,3,4-oxadiazol-2-amine;molecular hydrogen
SMILESCC(C)c1nnc(NC2CC2)o1.[H][H]
InChIInChI=1S/C8H13N3O.H2/c1-5(2)7-10-11-8(12-7)9-6-3-4-6;/h5-6H,3-4H2,1-2H3,(H,9,11);1H
InChIKeyGWJBHLOFPWYJLC-UHFFFAOYSA-N
MW169.23 g/mol
LogP2.01
Rot. Bonds3

About N-cyclopropyl-5-propan-2-yl-1,3,4-oxadiazol-2-amine;molecular hydrogen

N-cyclopropyl-5-propan-2-yl-1,3,4-oxadiazol-2-amine;molecular hydrogen (PubChem CID 169163463) has the molecular formula C8H15N3O and a molecular weight of 169.23 g/mol. Its IUPAC name is N-cyclopropyl-5-propan-2-yl-1,3,4-oxadiazol-2-amine;molecular hydrogen.

Molecular Properties

Compound NameN-cyclopropyl-5-propan-2-yl-1,3,4-oxadiazol-2-amine;molecular hydrogen
PubChem CID169163463
Molecular FormulaC8H15N3O
Molecular Weight169.23 g/mol
Exact Mass169.12
IUPAC NameN-cyclopropyl-5-propan-2-yl-1,3,4-oxadiazol-2-amine;molecular hydrogen
SMILESCC(C)c1nnc(NC2CC2)o1.[H][H]
InChIInChI=1S/C8H13N3O.H2/c1-5(2)7-10-11-8(12-7)9-6-3-4-6;/h5-6H,3-4H2,1-2H3,(H,9,11);1H
InChIKeyGWJBHLOFPWYJLC-UHFFFAOYSA-N
XLogP2.01
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.23
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-cyclopropyl-5-propan-2-yl-1,3,4-oxadiazol-2-amine;molecular hydrogen 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 N-cyclopropyl-5-propan-2-yl-1,3,4-oxadiazol-2-amine;molecular hydrogen?
The IUPAC name of N-cyclopropyl-5-propan-2-yl-1,3,4-oxadiazol-2-amine;molecular hydrogen (CID 169163463) is N-cyclopropyl-5-propan-2-yl-1,3,4-oxadiazol-2-amine;molecular hydrogen.
What is the SMILES notation for N-cyclopropyl-5-propan-2-yl-1,3,4-oxadiazol-2-amine;molecular hydrogen?
The canonical SMILES for N-cyclopropyl-5-propan-2-yl-1,3,4-oxadiazol-2-amine;molecular hydrogen is CC(C)c1nnc(NC2CC2)o1.[H][H].
What is the InChIKey of N-cyclopropyl-5-propan-2-yl-1,3,4-oxadiazol-2-amine;molecular hydrogen?
The InChIKey is GWJBHLOFPWYJLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O.H2/c1-5(2)7-10-11-8(12-7)9-6-3-4-6;/h5-6H,3-4H2,1-2H3,(H,9,11);1H.
What are the key properties of N-cyclopropyl-5-propan-2-yl-1,3,4-oxadiazol-2-amine;molecular hydrogen?
N-cyclopropyl-5-propan-2-yl-1,3,4-oxadiazol-2-amine;molecular hydrogen has a molecular weight of 169.23 g/mol, XLogP of 2.01, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-5-propan-2-yl-1,3,4-oxadiazol-2-amine;molecular hydrogen is sourced from PubChem (CID 169163463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).