4-amino-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxamide

C12H18N4O2 — CID 61254656

IUPAC4-amino-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxamide
SMILESNC1CCC(C(=O)Nc2nnc(C3CC3)o2)CC1
InChIInChI=1S/C12H18N4O2/c13-9-5-3-7(4-6-9)10(17)14-12-16-15-11(18-12)8-1-2-8/h7-9H,1-6,13H2,(H,14,16,17)
InChIKeyMSSJXAKMKISITK-UHFFFAOYSA-N
MW250.30 g/mol
LogP1.40
Rot. Bonds3

About 4-amino-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxamide

4-amino-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxamide (PubChem CID 61254656) has the molecular formula C12H18N4O2 and a molecular weight of 250.30 g/mol. Its IUPAC name is 4-amino-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name4-amino-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxamide
PubChem CID61254656
Molecular FormulaC12H18N4O2
Molecular Weight250.30 g/mol
Exact Mass250.14
IUPAC Name4-amino-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxamide
SMILESNC1CCC(C(=O)Nc2nnc(C3CC3)o2)CC1
InChIInChI=1S/C12H18N4O2/c13-9-5-3-7(4-6-9)10(17)14-12-16-15-11(18-12)8-1-2-8/h7-9H,1-6,13H2,(H,14,16,17)
InChIKeyMSSJXAKMKISITK-UHFFFAOYSA-N
XLogP1.40
TPSA94.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-amino-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxamide 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 4-amino-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxamide?
The IUPAC name of 4-amino-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxamide (CID 61254656) is 4-amino-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxamide.
What is the SMILES notation for 4-amino-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxamide?
The canonical SMILES for 4-amino-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxamide is NC1CCC(C(=O)Nc2nnc(C3CC3)o2)CC1.
What is the InChIKey of 4-amino-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxamide?
The InChIKey is MSSJXAKMKISITK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O2/c13-9-5-3-7(4-6-9)10(17)14-12-16-15-11(18-12)8-1-2-8/h7-9H,1-6,13H2,(H,14,16,17).
What are the key properties of 4-amino-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxamide?
4-amino-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxamide has a molecular weight of 250.30 g/mol, XLogP of 1.40, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxamide is sourced from PubChem (CID 61254656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).