2-[3-(1-methylpyrazol-3-yl)-1,2,4-oxadiazol-5-yl]pentan-2-amine

C11H17N5O — CID 65195957

IUPAC2-[3-(1-methylpyrazol-3-yl)-1,2,4-oxadiazol-5-yl]pentan-2-amine
SMILESCCCC(C)(N)c1nc(-c2ccn(C)n2)no1
InChIInChI=1S/C11H17N5O/c1-4-6-11(2,12)10-13-9(15-17-10)8-5-7-16(3)14-8/h5,7H,4,6,12H2,1-3H3
InChIKeyXAYOJVPFWXTUKN-UHFFFAOYSA-N
MW235.29 g/mol
LogP1.44
Rot. Bonds4

About 2-[3-(1-methylpyrazol-3-yl)-1,2,4-oxadiazol-5-yl]pentan-2-amine

2-[3-(1-methylpyrazol-3-yl)-1,2,4-oxadiazol-5-yl]pentan-2-amine (PubChem CID 65195957) has the molecular formula C11H17N5O and a molecular weight of 235.29 g/mol. Its IUPAC name is 2-[3-(1-methylpyrazol-3-yl)-1,2,4-oxadiazol-5-yl]pentan-2-amine.

Molecular Properties

Compound Name2-[3-(1-methylpyrazol-3-yl)-1,2,4-oxadiazol-5-yl]pentan-2-amine
PubChem CID65195957
Molecular FormulaC11H17N5O
Molecular Weight235.29 g/mol
Exact Mass235.14
IUPAC Name2-[3-(1-methylpyrazol-3-yl)-1,2,4-oxadiazol-5-yl]pentan-2-amine
SMILESCCCC(C)(N)c1nc(-c2ccn(C)n2)no1
InChIInChI=1S/C11H17N5O/c1-4-6-11(2,12)10-13-9(15-17-10)8-5-7-16(3)14-8/h5,7H,4,6,12H2,1-3H3
InChIKeyXAYOJVPFWXTUKN-UHFFFAOYSA-N
XLogP1.44
TPSA82.76 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-[3-(1-methylpyrazol-3-yl)-1,2,4-oxadiazol-5-yl]pentan-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

2-methyl-N-[2-(5-propyl-1,2,4-oxadiazol-3-yl)propan-2-yl]pyrazole-3-carboxamide
CID 53537763
N-[2-[5-[(dimethylamino)methyl]-1,2,4-oxadiazol-3-yl]propan-2-yl]-2-methylpyrazole-3-carboxamide
CID 53538181
N-[2-(5-tert-butyl-1,2,4-oxadiazol-3-yl)propan-2-yl]-2-methylpyrazole-3-carboxamide
CID 53547449
N-[(1-allyl-3-methyl-1H-pyrazol-4-yl)methyl]-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]ethanamine
CID 46998686
N-[(1-allyl-3-methyl-1H-pyrazol-4-yl)methyl]-N-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]ethanamine
CID 50984018
N-[(5-butyl-1,2,4-oxadiazol-3-yl)methyl]-2-pyrazol-1-ylethanamine
CID 56781260
3-(2-Methylpropyl)-5-[(3-methylpyrazol-1-yl)methyl]-1,2,4-oxadiazole
CID 75514064
1-ethyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-1H-pyrazole-3-carboxamide
CID 91917578
5-Cyclobutyl-3-[(2-methylpyrazol-3-yl)methyl]-1,2,4-oxadiazole
CID 100691727
N-[(1S)-1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]-3-(5-methylpyrazol-1-yl)propanamide
CID 124854193
N-[(1R)-2-methyl-1-[3-(1-methylpyrazol-3-yl)-1,2,4-oxadiazol-5-yl]propyl]cyclopropanesulfonamide
CID 132393560
3-[(1S)-1-(1-methylcyclopropyl)ethyl]-5-[(3-methylpyrazol-1-yl)methyl]-1,2,4-oxadiazole
CID 164640945

Frequently Asked Questions

What is the IUPAC name of 2-[3-(1-methylpyrazol-3-yl)-1,2,4-oxadiazol-5-yl]pentan-2-amine?
The IUPAC name of 2-[3-(1-methylpyrazol-3-yl)-1,2,4-oxadiazol-5-yl]pentan-2-amine (CID 65195957) is 2-[3-(1-methylpyrazol-3-yl)-1,2,4-oxadiazol-5-yl]pentan-2-amine.
What is the SMILES notation for 2-[3-(1-methylpyrazol-3-yl)-1,2,4-oxadiazol-5-yl]pentan-2-amine?
The canonical SMILES for 2-[3-(1-methylpyrazol-3-yl)-1,2,4-oxadiazol-5-yl]pentan-2-amine is CCCC(C)(N)c1nc(-c2ccn(C)n2)no1.
What is the InChIKey of 2-[3-(1-methylpyrazol-3-yl)-1,2,4-oxadiazol-5-yl]pentan-2-amine?
The InChIKey is XAYOJVPFWXTUKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5O/c1-4-6-11(2,12)10-13-9(15-17-10)8-5-7-16(3)14-8/h5,7H,4,6,12H2,1-3H3.
What are the key properties of 2-[3-(1-methylpyrazol-3-yl)-1,2,4-oxadiazol-5-yl]pentan-2-amine?
2-[3-(1-methylpyrazol-3-yl)-1,2,4-oxadiazol-5-yl]pentan-2-amine has a molecular weight of 235.29 g/mol, XLogP of 1.44, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(1-methylpyrazol-3-yl)-1,2,4-oxadiazol-5-yl]pentan-2-amine is sourced from PubChem (CID 65195957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).