1-methyl-3-[3-(2-propyl-1,3-oxazol-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-3-amine

C13H19N5O2 — CID 154795124

IUPAC1-methyl-3-[3-(2-propyl-1,3-oxazol-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-3-amine
SMILESCCCc1nc(-c2noc(C3(N)CCN(C)C3)n2)co1
InChIInChI=1S/C13H19N5O2/c1-3-4-10-15-9(7-19-10)11-16-12(20-17-11)13(14)5-6-18(2)8-13/h7H,3-6,8,14H2,1-2H3
InChIKeyGPLUTLDKOWBZCZ-UHFFFAOYSA-N
MW277.33 g/mol
LogP1.17
Rot. Bonds4

About 1-methyl-3-[3-(2-propyl-1,3-oxazol-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-3-amine

1-methyl-3-[3-(2-propyl-1,3-oxazol-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-3-amine (PubChem CID 154795124) has the molecular formula C13H19N5O2 and a molecular weight of 277.33 g/mol. Its IUPAC name is 1-methyl-3-[3-(2-propyl-1,3-oxazol-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-3-amine.

Molecular Properties

Compound Name1-methyl-3-[3-(2-propyl-1,3-oxazol-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-3-amine
PubChem CID154795124
Molecular FormulaC13H19N5O2
Molecular Weight277.33 g/mol
Exact Mass277.15
IUPAC Name1-methyl-3-[3-(2-propyl-1,3-oxazol-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-3-amine
SMILESCCCc1nc(-c2noc(C3(N)CCN(C)C3)n2)co1
InChIInChI=1S/C13H19N5O2/c1-3-4-10-15-9(7-19-10)11-16-12(20-17-11)13(14)5-6-18(2)8-13/h7H,3-6,8,14H2,1-2H3
InChIKeyGPLUTLDKOWBZCZ-UHFFFAOYSA-N
XLogP1.17
TPSA94.21 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.33
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 1-methyl-3-[3-(2-propyl-1,3-oxazol-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-3-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-(2,2-dimethylcyclopentyl)-3-(2-propyl-1,3-oxazol-4-yl)-1,2,4-oxadiazole
CID 139002646
5-cyclohexyl-3-(2-propyl-1,3-oxazol-4-yl)-1,2,4-oxadiazole
CID 139002647
1-methyl-3-[3-[4-propan-2-yloxy-2-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl]pyrrolidin-3-amine
CID 166238932
1-propyl-4-(5-propyl-1,2,4-oxadiazol-3-yl)azepan-4-amine
CID 65077748
1-phenyl-4-(5-propyl-1,2,4-oxadiazol-3-yl)piperidin-4-amine
CID 106820751
4-(1,3-oxazol-4-yl)-2-propyl-1,3-oxazole
CID 89186950
1-ethyl-4-(5-propyl-1,2,4-oxadiazol-3-yl)azepan-4-amine
CID 65077749
3-(2-propyl-1,3-oxazol-4-yl)propan-1-amine
CID 115084229
1-[3-(4-methyl-2-pyridinyl)-1,2,4-oxadiazol-5-yl]cyclopentan-1-amine
CID 63839712
1-[3-(6-methyl-2-pyridinyl)-1,2,4-oxadiazol-5-yl]cyclobutan-1-amine
CID 81162267
1-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]cyclopentan-1-amine
CID 62716804
1-[3-(2-methylfuran-3-yl)-1,2,4-oxadiazol-5-yl]cyclopropan-1-amine
CID 104788996

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-[3-(2-propyl-1,3-oxazol-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-3-amine?
The IUPAC name of 1-methyl-3-[3-(2-propyl-1,3-oxazol-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-3-amine (CID 154795124) is 1-methyl-3-[3-(2-propyl-1,3-oxazol-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-3-amine.
What is the SMILES notation for 1-methyl-3-[3-(2-propyl-1,3-oxazol-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-3-amine?
The canonical SMILES for 1-methyl-3-[3-(2-propyl-1,3-oxazol-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-3-amine is CCCc1nc(-c2noc(C3(N)CCN(C)C3)n2)co1.
What is the InChIKey of 1-methyl-3-[3-(2-propyl-1,3-oxazol-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-3-amine?
The InChIKey is GPLUTLDKOWBZCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N5O2/c1-3-4-10-15-9(7-19-10)11-16-12(20-17-11)13(14)5-6-18(2)8-13/h7H,3-6,8,14H2,1-2H3.
What are the key properties of 1-methyl-3-[3-(2-propyl-1,3-oxazol-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-3-amine?
1-methyl-3-[3-(2-propyl-1,3-oxazol-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-3-amine has a molecular weight of 277.33 g/mol, XLogP of 1.17, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-[3-(2-propyl-1,3-oxazol-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-3-amine is sourced from PubChem (CID 154795124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).