(4-cyclopropylphenyl)-(5-propyl-1,2,4-oxadiazol-3-yl)methanamine

C15H19N3O — CID 79980476

IUPAC(4-cyclopropylphenyl)-(5-propyl-1,2,4-oxadiazol-3-yl)methanamine
SMILESCCCc1nc(C(N)c2ccc(C3CC3)cc2)no1
InChIInChI=1S/C15H19N3O/c1-2-3-13-17-15(18-19-13)14(16)12-8-6-11(7-9-12)10-4-5-10/h6-10,14H,2-5,16H2,1H3
InChIKeyDCXALOLPJVRXQK-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.95
Rot. Bonds5

About (4-cyclopropylphenyl)-(5-propyl-1,2,4-oxadiazol-3-yl)methanamine

(4-cyclopropylphenyl)-(5-propyl-1,2,4-oxadiazol-3-yl)methanamine (PubChem CID 79980476) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is (4-cyclopropylphenyl)-(5-propyl-1,2,4-oxadiazol-3-yl)methanamine.

Molecular Properties

Compound Name(4-cyclopropylphenyl)-(5-propyl-1,2,4-oxadiazol-3-yl)methanamine
PubChem CID79980476
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name(4-cyclopropylphenyl)-(5-propyl-1,2,4-oxadiazol-3-yl)methanamine
SMILESCCCc1nc(C(N)c2ccc(C3CC3)cc2)no1
InChIInChI=1S/C15H19N3O/c1-2-3-13-17-15(18-19-13)14(16)12-8-6-11(7-9-12)10-4-5-10/h6-10,14H,2-5,16H2,1H3
InChIKeyDCXALOLPJVRXQK-UHFFFAOYSA-N
XLogP2.95
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (4-cyclopropylphenyl)-(5-propyl-1,2,4-oxadiazol-3-yl)methanamine 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

phenyl-(5-propyl-1,2,4-oxadiazol-3-yl)methanamine;hydrochloride
CID 54594395
(3,4-dimethylphenyl)-(5-propyl-1,2,4-oxadiazol-3-yl)methanamine
CID 43753558
(3,5-difluorophenyl)-(5-propyl-1,2,4-oxadiazol-3-yl)methanamine
CID 106531793
(7-chloro-1,3-benzodioxol-5-yl)-(5-propyl-1,2,4-oxadiazol-3-yl)methanamine
CID 43559561
(5-methyloxolan-2-yl)-(5-propyl-1,2,4-oxadiazol-3-yl)methanamine
CID 82838432
3-[4-[4-(4-pentylcyclohexyl)phenyl]phenyl]-5-propyl-1,2,4-oxadiazole
CID 101044576
(2-chloro-4-fluorophenyl)-(5-propyl-1,2,4-oxadiazol-3-yl)methanamine
CID 114064742
(5-ethyl-1,2,4-oxadiazol-3-yl)-[4-(trifluoromethylsulfanyl)phenyl]methanamine
CID 43559370
(2-chloro-3,4-dimethoxyphenyl)-(5-propyl-1,2,4-oxadiazol-3-yl)methanamine
CID 63632238
(5-ethyl-1,2,4-oxadiazol-3-yl)-(3-fluoro-4-methylphenyl)methanamine
CID 63647944
(3-bromo-4-fluorophenyl)-(5-ethyl-1,2,4-oxadiazol-3-yl)methanamine
CID 43559376
1-(4-cyclopropylphenyl)ethanamine
CID 55211304

Frequently Asked Questions

What is the IUPAC name of (4-cyclopropylphenyl)-(5-propyl-1,2,4-oxadiazol-3-yl)methanamine?
The IUPAC name of (4-cyclopropylphenyl)-(5-propyl-1,2,4-oxadiazol-3-yl)methanamine (CID 79980476) is (4-cyclopropylphenyl)-(5-propyl-1,2,4-oxadiazol-3-yl)methanamine.
What is the SMILES notation for (4-cyclopropylphenyl)-(5-propyl-1,2,4-oxadiazol-3-yl)methanamine?
The canonical SMILES for (4-cyclopropylphenyl)-(5-propyl-1,2,4-oxadiazol-3-yl)methanamine is CCCc1nc(C(N)c2ccc(C3CC3)cc2)no1.
What is the InChIKey of (4-cyclopropylphenyl)-(5-propyl-1,2,4-oxadiazol-3-yl)methanamine?
The InChIKey is DCXALOLPJVRXQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-2-3-13-17-15(18-19-13)14(16)12-8-6-11(7-9-12)10-4-5-10/h6-10,14H,2-5,16H2,1H3.
What are the key properties of (4-cyclopropylphenyl)-(5-propyl-1,2,4-oxadiazol-3-yl)methanamine?
(4-cyclopropylphenyl)-(5-propyl-1,2,4-oxadiazol-3-yl)methanamine has a molecular weight of 257.34 g/mol, XLogP of 2.95, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-cyclopropylphenyl)-(5-propyl-1,2,4-oxadiazol-3-yl)methanamine is sourced from PubChem (CID 79980476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).