N-cyclohexyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-ethyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-(4-methylphenyl)-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-phenyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine

C65H56N16O4 — CID 158740817

IUPACN-cyclohexyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-ethyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-(4-methylphenyl)-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-phenyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine
SMILESCCNc1nnc(-c2ccc3ncccc3c2)o1.Cc1ccc(Nc2nnc(-c3ccc4ncccc4c3)o2)cc1.c1ccc(Nc2nnc(-c3ccc4ncccc4c3)o2)cc1.c1cnc2ccc(-c3nnc(NC4CCCCC4)o3)cc2c1
InChIInChI=1S/C18H14N4O.C17H18N4O.C17H12N4O.C13H12N4O/c1-12-4-7-15(8-5-12)20-18-22-21-17(23-18)14-6-9-16-13(11-14)3-2-10-19-16;2*1-2-6-14(7-3-1)19-17-21-20-16(22-17)13-8-9-15-12(11-13)5-4-10-18-15;1-2-14-13-17-16-12(18-13)10-5-6-11-9(8-10)4-3-7-15-11/h2-11H,1H3,(H,20,22);4-5,8-11,14H,1-3,6-7H2,(H,19,21);1-11H,(H,19,21);3-8H,2H2,1H3,(H,14,17)
InChIKeyIMGRIDBMEGQXOV-UHFFFAOYSA-N
MW1125.27 g/mol
LogP15.11
Rot. Bonds12

About N-cyclohexyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-ethyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-(4-methylphenyl)-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-phenyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine

N-cyclohexyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-ethyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-(4-methylphenyl)-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-phenyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine (PubChem CID 158740817) has the molecular formula C65H56N16O4 and a molecular weight of 1125.27 g/mol. Its IUPAC name is N-cyclohexyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-ethyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-(4-methylphenyl)-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-phenyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine.

Molecular Properties

Compound NameN-cyclohexyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-ethyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-(4-methylphenyl)-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-phenyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine
PubChem CID158740817
Molecular FormulaC65H56N16O4
Molecular Weight1125.27 g/mol
Exact Mass1124.47
IUPAC NameN-cyclohexyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-ethyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-(4-methylphenyl)-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-phenyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine
SMILESCCNc1nnc(-c2ccc3ncccc3c2)o1.Cc1ccc(Nc2nnc(-c3ccc4ncccc4c3)o2)cc1.c1ccc(Nc2nnc(-c3ccc4ncccc4c3)o2)cc1.c1cnc2ccc(-c3nnc(NC4CCCCC4)o3)cc2c1
InChIInChI=1S/C18H14N4O.C17H18N4O.C17H12N4O.C13H12N4O/c1-12-4-7-15(8-5-12)20-18-22-21-17(23-18)14-6-9-16-13(11-14)3-2-10-19-16;2*1-2-6-14(7-3-1)19-17-21-20-16(22-17)13-8-9-15-12(11-13)5-4-10-18-15;1-2-14-13-17-16-12(18-13)10-5-6-11-9(8-10)4-3-7-15-11/h2-11H,1H3,(H,20,22);4-5,8-11,14H,1-3,6-7H2,(H,19,21);1-11H,(H,19,21);3-8H,2H2,1H3,(H,14,17)
InChIKeyIMGRIDBMEGQXOV-UHFFFAOYSA-N
XLogP15.11
TPSA255.36 Ų
H-Bond Donors4
H-Bond Acceptors20
Rotatable Bonds12
Heavy Atoms85
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001125.27
LogP ≤ 515.11
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1020

Analyze N-cyclohexyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-ethyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-(4-methylphenyl)-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-phenyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine with MolForge

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

Launch Full Analysis

Related Compounds

N-(4-methylphenyl)-2-(5-quinolin-6-yl-1,3,4-oxadiazol-2-yl)acetamide
CID 53162164
N-cyclopropyl-5-(3-methylphenyl)-1,3,4-oxadiazol-2-amine
CID 83886680
N-(4-methylphenyl)-2-[(5-quinolin-6-yl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide
CID 86573495
N-ethyl-1-(5-quinolin-6-yl-1,3,4-oxadiazol-2-yl)propan-1-amine
CID 62858258
N-cyclohexyl-5-quinolin-2-yl-1,3,4-oxadiazol-2-amine
CID 24938624
4-N-cyclopropyl-6-N-quinolin-6-ylpyrimidine-4,6-diamine
CID 117083767
5-(1,3-benzodioxol-5-yl)-N-cyclohexyl-1,3,4-oxadiazol-2-amine
CID 4799055
N,5-diphenyl-1,3,4-oxadiazol-2-amine
CID 12616884
6-N-ethyl-4-N-quinolin-6-ylpyrimidine-4,6-diamine
CID 80832323
5-quinolin-6-yl-1,3,4-oxadiazol-2-amine
CID 62850439
5-[3-(4-methylphenyl)-1H-pyrazol-5-yl]-N-phenyl-1,3,4-oxadiazol-2-amine
CID 11045337
4-N-cyclohexyl-2-methyl-6-N-(4-methylphenyl)pyrimidine-4,6-diamine
CID 112869053

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-ethyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-(4-methylphenyl)-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-phenyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine?
The IUPAC name of N-cyclohexyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-ethyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-(4-methylphenyl)-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-phenyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine (CID 158740817) is N-cyclohexyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-ethyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-(4-methylphenyl)-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-phenyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine.
What is the SMILES notation for N-cyclohexyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-ethyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-(4-methylphenyl)-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-phenyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine?
The canonical SMILES for N-cyclohexyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-ethyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-(4-methylphenyl)-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-phenyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine is CCNc1nnc(-c2ccc3ncccc3c2)o1.Cc1ccc(Nc2nnc(-c3ccc4ncccc4c3)o2)cc1.c1ccc(Nc2nnc(-c3ccc4ncccc4c3)o2)cc1.c1cnc2ccc(-c3nnc(NC4CCCCC4)o3)cc2c1.
What is the InChIKey of N-cyclohexyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-ethyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-(4-methylphenyl)-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-phenyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine?
The InChIKey is IMGRIDBMEGQXOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N4O.C17H18N4O.C17H12N4O.C13H12N4O/c1-12-4-7-15(8-5-12)20-18-22-21-17(23-18)14-6-9-16-13(11-14)3-2-10-19-16;2*1-2-6-14(7-3-1)19-17-21-20-16(22-17)13-8-9-15-12(11-13)5-4-10-18-15;1-2-14-13-17-16-12(18-13)10-5-6-11-9(8-10)4-3-7-15-11/h2-11H,1H3,(H,20,22);4-5,8-11,14H,1-3,6-7H2,(H,19,21);1-11H,(H,19,21);3-8H,2H2,1H3,(H,14,17).
What are the key properties of N-cyclohexyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-ethyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-(4-methylphenyl)-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-phenyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine?
N-cyclohexyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-ethyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-(4-methylphenyl)-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-phenyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine has a molecular weight of 1125.27 g/mol, XLogP of 15.11, 12 rotatable bonds, 4 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-ethyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-(4-methylphenyl)-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine;N-phenyl-5-quinolin-6-yl-1,3,4-oxadiazol-2-amine is sourced from PubChem (CID 158740817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).