N-[4-[3-(3-methyl-2-pyridinyl)-1,2,4-oxadiazol-5-yl]phenyl]pyridin-3-amine

C19H15N5O — CID 154783031

IUPACN-[4-[3-(3-methyl-2-pyridinyl)-1,2,4-oxadiazol-5-yl]phenyl]pyridin-3-amine
SMILESCc1cccnc1-c1noc(-c2ccc(Nc3cccnc3)cc2)n1
InChIInChI=1S/C19H15N5O/c1-13-4-2-11-21-17(13)18-23-19(25-24-18)14-6-8-15(9-7-14)22-16-5-3-10-20-12-16/h2-12,22H,1H3
InChIKeyUDWCSHUELOERIC-UHFFFAOYSA-N
MW329.36 g/mol
LogP4.25
Rot. Bonds4

About N-[4-[3-(3-methyl-2-pyridinyl)-1,2,4-oxadiazol-5-yl]phenyl]pyridin-3-amine

N-[4-[3-(3-methyl-2-pyridinyl)-1,2,4-oxadiazol-5-yl]phenyl]pyridin-3-amine (PubChem CID 154783031) has the molecular formula C19H15N5O and a molecular weight of 329.36 g/mol. Its IUPAC name is N-[4-[3-(3-methyl-2-pyridinyl)-1,2,4-oxadiazol-5-yl]phenyl]pyridin-3-amine.

Molecular Properties

Compound NameN-[4-[3-(3-methyl-2-pyridinyl)-1,2,4-oxadiazol-5-yl]phenyl]pyridin-3-amine
PubChem CID154783031
Molecular FormulaC19H15N5O
Molecular Weight329.36 g/mol
Exact Mass329.13
IUPAC NameN-[4-[3-(3-methyl-2-pyridinyl)-1,2,4-oxadiazol-5-yl]phenyl]pyridin-3-amine
SMILESCc1cccnc1-c1noc(-c2ccc(Nc3cccnc3)cc2)n1
InChIInChI=1S/C19H15N5O/c1-13-4-2-11-21-17(13)18-23-19(25-24-18)14-6-8-15(9-7-14)22-16-5-3-10-20-12-16/h2-12,22H,1H3
InChIKeyUDWCSHUELOERIC-UHFFFAOYSA-N
XLogP4.25
TPSA76.73 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.36
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[4-[3-(3-methyl-2-pyridinyl)-1,2,4-oxadiazol-5-yl]phenyl]pyridin-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-[3-(3-methyl-2-pyridinyl)-1,2,4-oxadiazol-5-yl]pyridin-2-amine
CID 63259812
[6-[3-(3-methyl-2-pyridinyl)-1,2,4-oxadiazol-5-yl]-3-pyridinyl]methanamine
CID 81099704
N-[4-[5-(aminomethyl)-1,2-oxazol-3-yl]phenyl]pyridin-3-amine
CID 68983729
5-(3-methyl-2-pyridinyl)-3-[2-[5-(3-methyl-2-pyridinyl)-1,2,4-oxadiazol-3-yl]phenyl]-1,2,4-oxadiazole
CID 125180484
1-[4-[3-(3-methyl-2-pyridinyl)-1,2,4-oxadiazol-5-yl]phenyl]-3-[N-methyl-C-[(E)-2,3,3-trimethylbut-1-enyl]carbonimidoyl]urea
CID 143052535
N-methyl-4-[3-(3-methyl-4-pyridinyl)-1,2,4-oxadiazol-5-yl]aniline
CID 104698932
4-[5-(4-methoxyphenyl)-1,2,4-oxadiazol-3-yl]-N-phenylaniline
CID 155374553
N-methyl-4-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)aniline
CID 104698802
2,4-dibromo-6-[3-(3-methyl-2-pyridinyl)-1,2,4-oxadiazol-5-yl]aniline
CID 63111766
ethane;N-(2-methylphenyl)pyridin-3-amine
CID 143449341
N-(3,4-dimethylphenyl)pyridin-3-amine
CID 82537517
3-methyl-5-(3-methyl-2-pyridinyl)-1,2,4-oxadiazole
CID 118391610

Frequently Asked Questions

What is the IUPAC name of N-[4-[3-(3-methyl-2-pyridinyl)-1,2,4-oxadiazol-5-yl]phenyl]pyridin-3-amine?
The IUPAC name of N-[4-[3-(3-methyl-2-pyridinyl)-1,2,4-oxadiazol-5-yl]phenyl]pyridin-3-amine (CID 154783031) is N-[4-[3-(3-methyl-2-pyridinyl)-1,2,4-oxadiazol-5-yl]phenyl]pyridin-3-amine.
What is the SMILES notation for N-[4-[3-(3-methyl-2-pyridinyl)-1,2,4-oxadiazol-5-yl]phenyl]pyridin-3-amine?
The canonical SMILES for N-[4-[3-(3-methyl-2-pyridinyl)-1,2,4-oxadiazol-5-yl]phenyl]pyridin-3-amine is Cc1cccnc1-c1noc(-c2ccc(Nc3cccnc3)cc2)n1.
What is the InChIKey of N-[4-[3-(3-methyl-2-pyridinyl)-1,2,4-oxadiazol-5-yl]phenyl]pyridin-3-amine?
The InChIKey is UDWCSHUELOERIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N5O/c1-13-4-2-11-21-17(13)18-23-19(25-24-18)14-6-8-15(9-7-14)22-16-5-3-10-20-12-16/h2-12,22H,1H3.
What are the key properties of N-[4-[3-(3-methyl-2-pyridinyl)-1,2,4-oxadiazol-5-yl]phenyl]pyridin-3-amine?
N-[4-[3-(3-methyl-2-pyridinyl)-1,2,4-oxadiazol-5-yl]phenyl]pyridin-3-amine has a molecular weight of 329.36 g/mol, XLogP of 4.25, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[3-(3-methyl-2-pyridinyl)-1,2,4-oxadiazol-5-yl]phenyl]pyridin-3-amine is sourced from PubChem (CID 154783031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).