2-amino-4-methyl-N-[2-methyl-4-(1,3,4-oxadiazol-2-yl)phenyl]pentanamide

C15H20N4O2 — CID 43713909

IUPAC2-amino-4-methyl-N-[2-methyl-4-(1,3,4-oxadiazol-2-yl)phenyl]pentanamide
SMILESCc1cc(-c2nnco2)ccc1NC(=O)C(N)CC(C)C
InChIInChI=1S/C15H20N4O2/c1-9(2)6-12(16)14(20)18-13-5-4-11(7-10(13)3)15-19-17-8-21-15/h4-5,7-9,12H,6,16H2,1-3H3,(H,18,20)
InChIKeyCZVCXPMNCKVYPF-UHFFFAOYSA-N
MW288.35 g/mol
LogP2.36
Rot. Bonds5

About 2-amino-4-methyl-N-[2-methyl-4-(1,3,4-oxadiazol-2-yl)phenyl]pentanamide

2-amino-4-methyl-N-[2-methyl-4-(1,3,4-oxadiazol-2-yl)phenyl]pentanamide (PubChem CID 43713909) has the molecular formula C15H20N4O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is 2-amino-4-methyl-N-[2-methyl-4-(1,3,4-oxadiazol-2-yl)phenyl]pentanamide.

Molecular Properties

Compound Name2-amino-4-methyl-N-[2-methyl-4-(1,3,4-oxadiazol-2-yl)phenyl]pentanamide
PubChem CID43713909
Molecular FormulaC15H20N4O2
Molecular Weight288.35 g/mol
Exact Mass288.16
IUPAC Name2-amino-4-methyl-N-[2-methyl-4-(1,3,4-oxadiazol-2-yl)phenyl]pentanamide
SMILESCc1cc(-c2nnco2)ccc1NC(=O)C(N)CC(C)C
InChIInChI=1S/C15H20N4O2/c1-9(2)6-12(16)14(20)18-13-5-4-11(7-10(13)3)15-19-17-8-21-15/h4-5,7-9,12H,6,16H2,1-3H3,(H,18,20)
InChIKeyCZVCXPMNCKVYPF-UHFFFAOYSA-N
XLogP2.36
TPSA94.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-methyl-N-(4-methylpentan-2-yl)-4-(1,3,4-oxadiazol-2-yl)aniline
CID 43735645
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
methyl 2-[2-methyl-4-(1,3,4-oxadiazol-2-yl)anilino]propanoate
CID 66174734
2-hydroxyethyl N-[2-methyl-4-(1,3,4-oxadiazol-2-yl)phenyl]carbamate
CID 79345905
2-amino-3-methyl-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]pentanamide
CID 43706136
2,2,2-trifluoroethyl N-[2-methyl-4-(1,3,4-oxadiazol-2-yl)phenyl]carbamate
CID 65173469
N-[2-methyl-4-(1,3,4-oxadiazol-2-yl)phenyl]ethanesulfonamide
CID 64585706
5-amino-4-methyl-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]pentanamide
CID 82013593
(2S)-2-amino-4-methyl-N-(2-methylphenyl)pentanamide
CID 22691032
1-(3-hydroxy-4-methylpentyl)-3-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]urea
CID 111474811
(2S)-2-amino-4-methyl-N-(2-methyl-4-nitrophenyl)pentanamide
CID 61178947

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-methyl-N-[2-methyl-4-(1,3,4-oxadiazol-2-yl)phenyl]pentanamide?
The IUPAC name of 2-amino-4-methyl-N-[2-methyl-4-(1,3,4-oxadiazol-2-yl)phenyl]pentanamide (CID 43713909) is 2-amino-4-methyl-N-[2-methyl-4-(1,3,4-oxadiazol-2-yl)phenyl]pentanamide.
What is the SMILES notation for 2-amino-4-methyl-N-[2-methyl-4-(1,3,4-oxadiazol-2-yl)phenyl]pentanamide?
The canonical SMILES for 2-amino-4-methyl-N-[2-methyl-4-(1,3,4-oxadiazol-2-yl)phenyl]pentanamide is Cc1cc(-c2nnco2)ccc1NC(=O)C(N)CC(C)C.
What is the InChIKey of 2-amino-4-methyl-N-[2-methyl-4-(1,3,4-oxadiazol-2-yl)phenyl]pentanamide?
The InChIKey is CZVCXPMNCKVYPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2/c1-9(2)6-12(16)14(20)18-13-5-4-11(7-10(13)3)15-19-17-8-21-15/h4-5,7-9,12H,6,16H2,1-3H3,(H,18,20).
What are the key properties of 2-amino-4-methyl-N-[2-methyl-4-(1,3,4-oxadiazol-2-yl)phenyl]pentanamide?
2-amino-4-methyl-N-[2-methyl-4-(1,3,4-oxadiazol-2-yl)phenyl]pentanamide has a molecular weight of 288.35 g/mol, XLogP of 2.36, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-methyl-N-[2-methyl-4-(1,3,4-oxadiazol-2-yl)phenyl]pentanamide is sourced from PubChem (CID 43713909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).