4-(methylamino)-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]butanamide

C14H18N4O2 — CID 60842599

IUPAC4-(methylamino)-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]butanamide
SMILESCNCCCC(=O)Nc1cc(-c2nnco2)ccc1C
InChIInChI=1S/C14H18N4O2/c1-10-5-6-11(14-18-16-9-20-14)8-12(10)17-13(19)4-3-7-15-2/h5-6,8-9,15H,3-4,7H2,1-2H3,(H,17,19)
InChIKeyRMTAHCOTQVPNJA-UHFFFAOYSA-N
MW274.32 g/mol
LogP1.98
Rot. Bonds6

About 4-(methylamino)-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]butanamide

4-(methylamino)-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]butanamide (PubChem CID 60842599) has the molecular formula C14H18N4O2 and a molecular weight of 274.32 g/mol. Its IUPAC name is 4-(methylamino)-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]butanamide.

Molecular Properties

Compound Name4-(methylamino)-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]butanamide
PubChem CID60842599
Molecular FormulaC14H18N4O2
Molecular Weight274.32 g/mol
Exact Mass274.14
IUPAC Name4-(methylamino)-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]butanamide
SMILESCNCCCC(=O)Nc1cc(-c2nnco2)ccc1C
InChIInChI=1S/C14H18N4O2/c1-10-5-6-11(14-18-16-9-20-14)8-12(10)17-13(19)4-3-7-15-2/h5-6,8-9,15H,3-4,7H2,1-2H3,(H,17,19)
InChIKeyRMTAHCOTQVPNJA-UHFFFAOYSA-N
XLogP1.98
TPSA80.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 4-(methylamino)-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]butanamide 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-(methylamino)-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]acetamide
CID 43706139
3-[2-methyl-5-(1,3,4-oxadiazol-2-yl)anilino]-3-oxopropanoic acid
CID 62230630
5-amino-4-methyl-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]pentanamide
CID 82013593
N-[4-[2-methyl-5-(1,3,4-oxadiazol-2-yl)anilino]-4-oxobutyl]thiophene-2-carboxamide
CID 55731494
N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]-2-pyridin-4-ylsulfanylacetamide
CID 51090247
2,2,2-trifluoro-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]acetamide
CID 63374700
3-chloro-2,2-dimethyl-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]propanamide
CID 63679608
2-bromo-N-[2-methyl-4-(1,3,4-oxadiazol-2-yl)phenyl]acetamide
CID 63681213
2-amino-3-methyl-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]butanamide
CID 43706124
N-(2,5-dimethylphenyl)-4-(methylamino)butanamide;hydrochloride
CID 119669251
N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]-2-(9-oxoacridin-10-yl)acetamide
CID 55731779
2-chloro-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]furan-3-carboxamide
CID 106685977

Frequently Asked Questions

What is the IUPAC name of 4-(methylamino)-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]butanamide?
The IUPAC name of 4-(methylamino)-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]butanamide (CID 60842599) is 4-(methylamino)-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]butanamide.
What is the SMILES notation for 4-(methylamino)-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]butanamide?
The canonical SMILES for 4-(methylamino)-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]butanamide is CNCCCC(=O)Nc1cc(-c2nnco2)ccc1C.
What is the InChIKey of 4-(methylamino)-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]butanamide?
The InChIKey is RMTAHCOTQVPNJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2/c1-10-5-6-11(14-18-16-9-20-14)8-12(10)17-13(19)4-3-7-15-2/h5-6,8-9,15H,3-4,7H2,1-2H3,(H,17,19).
What are the key properties of 4-(methylamino)-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]butanamide?
4-(methylamino)-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]butanamide has a molecular weight of 274.32 g/mol, XLogP of 1.98, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methylamino)-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]butanamide is sourced from PubChem (CID 60842599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).