2-(N-methylanilino)-N-[(1S)-1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]benzamide

C19H20N4O2 — CID 97008975

IUPAC2-(N-methylanilino)-N-[(1S)-1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]benzamide
SMILESCc1noc([C@H](C)NC(=O)c2ccccc2N(C)c2ccccc2)n1
InChIInChI=1S/C19H20N4O2/c1-13(19-21-14(2)22-25-19)20-18(24)16-11-7-8-12-17(16)23(3)15-9-5-4-6-10-15/h4-13H,1-3H3,(H,20,24)/t13-/m0/s1
InChIKeyMUCFMLBNBWPXOW-ZDUSSCGKSA-N
MW336.40 g/mol
LogP3.64
Rot. Bonds5

About 2-(N-methylanilino)-N-[(1S)-1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]benzamide

2-(N-methylanilino)-N-[(1S)-1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]benzamide (PubChem CID 97008975) has the molecular formula C19H20N4O2 and a molecular weight of 336.40 g/mol. Its IUPAC name is 2-(N-methylanilino)-N-[(1S)-1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]benzamide.

Molecular Properties

Compound Name2-(N-methylanilino)-N-[(1S)-1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]benzamide
PubChem CID97008975
Molecular FormulaC19H20N4O2
Molecular Weight336.40 g/mol
Exact Mass336.16
IUPAC Name2-(N-methylanilino)-N-[(1S)-1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]benzamide
SMILESCc1noc([C@H](C)NC(=O)c2ccccc2N(C)c2ccccc2)n1
InChIInChI=1S/C19H20N4O2/c1-13(19-21-14(2)22-25-19)20-18(24)16-11-7-8-12-17(16)23(3)15-9-5-4-6-10-15/h4-13H,1-3H3,(H,20,24)/t13-/m0/s1
InChIKeyMUCFMLBNBWPXOW-ZDUSSCGKSA-N
XLogP3.64
TPSA71.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-fluorobenzoyl)-N-[(1S)-1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]benzamide
CID 97315521
N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-(N-methylanilino)benzamide
CID 71894359
2,4-dimethyl-N-[(1S)-1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]benzamide
CID 94789301
N-methoxy-2-(N-methylanilino)benzamide
CID 47216174
2-(furan-2-yl)-N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]quinoline-4-carboxamide
CID 56822225
N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]-2,3-diphenyl-3,4-dihydropyrazole-5-carboxamide
CID 51129173
N-[1-(4-benzoylpiperazin-1-yl)ethyl]-2-(N-methylanilino)benzamide
CID 67184535
N-[2-(methylamino)propyl]-2-(N-methylanilino)benzamide
CID 120832793
2-methyl-N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pyrazole-3-carboxamide
CID 146083478
2-(2-ethylphenoxy)-N-[(1R)-1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]acetamide
CID 94820638
tert-butyl N-[(1S)-1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]carbamate
CID 56770615
3-bromo-1-methyl-N-[(1R)-1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]indole-2-carboxamide
CID 52537910

Frequently Asked Questions

What is the IUPAC name of 2-(N-methylanilino)-N-[(1S)-1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]benzamide?
The IUPAC name of 2-(N-methylanilino)-N-[(1S)-1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]benzamide (CID 97008975) is 2-(N-methylanilino)-N-[(1S)-1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]benzamide.
What is the SMILES notation for 2-(N-methylanilino)-N-[(1S)-1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]benzamide?
The canonical SMILES for 2-(N-methylanilino)-N-[(1S)-1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]benzamide is Cc1noc([C@H](C)NC(=O)c2ccccc2N(C)c2ccccc2)n1.
What is the InChIKey of 2-(N-methylanilino)-N-[(1S)-1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]benzamide?
The InChIKey is MUCFMLBNBWPXOW-ZDUSSCGKSA-N. The full InChI is InChI=1S/C19H20N4O2/c1-13(19-21-14(2)22-25-19)20-18(24)16-11-7-8-12-17(16)23(3)15-9-5-4-6-10-15/h4-13H,1-3H3,(H,20,24)/t13-/m0/s1.
What are the key properties of 2-(N-methylanilino)-N-[(1S)-1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]benzamide?
2-(N-methylanilino)-N-[(1S)-1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]benzamide has a molecular weight of 336.40 g/mol, XLogP of 3.64, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-methylanilino)-N-[(1S)-1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]benzamide is sourced from PubChem (CID 97008975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).