5-(1-aminoethyl)-N-phenyl-1,3,4-oxadiazol-2-amine

C10H12N4O — CID 103846511

IUPAC5-(1-aminoethyl)-N-phenyl-1,3,4-oxadiazol-2-amine
SMILESCC(N)c1nnc(Nc2ccccc2)o1
InChIInChI=1S/C10H12N4O/c1-7(11)9-13-14-10(15-9)12-8-5-3-2-4-6-8/h2-7H,11H2,1H3,(H,12,14)
InChIKeyRSEXLCNJTNXNPB-UHFFFAOYSA-N
MW204.23 g/mol
LogP1.83
Rot. Bonds3

About 5-(1-aminoethyl)-N-phenyl-1,3,4-oxadiazol-2-amine

5-(1-aminoethyl)-N-phenyl-1,3,4-oxadiazol-2-amine (PubChem CID 103846511) has the molecular formula C10H12N4O and a molecular weight of 204.23 g/mol. Its IUPAC name is 5-(1-aminoethyl)-N-phenyl-1,3,4-oxadiazol-2-amine.

Molecular Properties

Compound Name5-(1-aminoethyl)-N-phenyl-1,3,4-oxadiazol-2-amine
PubChem CID103846511
Molecular FormulaC10H12N4O
Molecular Weight204.23 g/mol
Exact Mass204.10
IUPAC Name5-(1-aminoethyl)-N-phenyl-1,3,4-oxadiazol-2-amine
SMILESCC(N)c1nnc(Nc2ccccc2)o1
InChIInChI=1S/C10H12N4O/c1-7(11)9-13-14-10(15-9)12-8-5-3-2-4-6-8/h2-7H,11H2,1H3,(H,12,14)
InChIKeyRSEXLCNJTNXNPB-UHFFFAOYSA-N
XLogP1.83
TPSA76.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 5-(1-aminoethyl)-N-phenyl-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

5-(1-aminoethyl)-N-(3-methylphenyl)-1,3,4-oxadiazol-2-amine
CID 106967977
4-[[5-(1-aminoethyl)-1,3,4-oxadiazol-2-yl]amino]benzenesulfonamide
CID 106966865
2-[4-[[5-(1-aminoethyl)-1,3,4-oxadiazol-2-yl]amino]phenyl]ethanol
CID 106969771
1-N-[5-(1-aminoethyl)-1,3,4-oxadiazol-2-yl]-4-N,4-N-diethylbenzene-1,4-diamine
CID 106960890
5-(1-aminoethyl)-N-(3-butan-2-yloxyphenyl)-1,3,4-oxadiazol-2-amine
CID 106960252
5-(1-chloroethyl)-N-(4-phenylphenyl)-1,3,4-oxadiazol-2-amine
CID 106957474
5-(1-aminoethyl)-N-[2-(difluoromethoxy)phenyl]-1,3,4-oxadiazol-2-amine
CID 106968528
5-(1-aminoethyl)-N-(3-fluoro-2-methylphenyl)-1,3,4-oxadiazol-2-amine
CID 106969926
5-(1-aminoethyl)-N-(2-bromo-3-chlorophenyl)-1,3,4-oxadiazol-2-amine
CID 106967337
5-(1-aminoethyl)-N-(4-bromo-2,3-dichlorophenyl)-1,3,4-oxadiazol-2-amine
CID 107795977
5-(1-aminoethyl)-N-[(2-chlorophenyl)methyl]-1,3,4-oxadiazol-2-amine
CID 110456355
5-(1-aminoethyl)-N-pentan-3-yl-1,3,4-oxadiazol-2-amine
CID 106967664

Frequently Asked Questions

What is the IUPAC name of 5-(1-aminoethyl)-N-phenyl-1,3,4-oxadiazol-2-amine?
The IUPAC name of 5-(1-aminoethyl)-N-phenyl-1,3,4-oxadiazol-2-amine (CID 103846511) is 5-(1-aminoethyl)-N-phenyl-1,3,4-oxadiazol-2-amine.
What is the SMILES notation for 5-(1-aminoethyl)-N-phenyl-1,3,4-oxadiazol-2-amine?
The canonical SMILES for 5-(1-aminoethyl)-N-phenyl-1,3,4-oxadiazol-2-amine is CC(N)c1nnc(Nc2ccccc2)o1.
What is the InChIKey of 5-(1-aminoethyl)-N-phenyl-1,3,4-oxadiazol-2-amine?
The InChIKey is RSEXLCNJTNXNPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O/c1-7(11)9-13-14-10(15-9)12-8-5-3-2-4-6-8/h2-7H,11H2,1H3,(H,12,14).
What are the key properties of 5-(1-aminoethyl)-N-phenyl-1,3,4-oxadiazol-2-amine?
5-(1-aminoethyl)-N-phenyl-1,3,4-oxadiazol-2-amine has a molecular weight of 204.23 g/mol, XLogP of 1.83, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-aminoethyl)-N-phenyl-1,3,4-oxadiazol-2-amine is sourced from PubChem (CID 103846511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).