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

C19H20N4O2 — CID 71977869

IUPACN,N-dimethyl-2-[2-[(5-phenyl-1,2,4-oxadiazol-3-yl)methylamino]phenyl]acetamide
SMILESCN(C)C(=O)Cc1ccccc1NCc1noc(-c2ccccc2)n1
InChIInChI=1S/C19H20N4O2/c1-23(2)18(24)12-15-10-6-7-11-16(15)20-13-17-21-19(25-22-17)14-8-4-3-5-9-14/h3-11,20H,12-13H2,1-2H3
InChIKeyRLYAMNAQFVZDMF-UHFFFAOYSA-N
MW336.40 g/mol
LogP2.98
Rot. Bonds6

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

N,N-dimethyl-2-[2-[(5-phenyl-1,2,4-oxadiazol-3-yl)methylamino]phenyl]acetamide (PubChem CID 71977869) has the molecular formula C19H20N4O2 and a molecular weight of 336.40 g/mol. Its IUPAC name is N,N-dimethyl-2-[2-[(5-phenyl-1,2,4-oxadiazol-3-yl)methylamino]phenyl]acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[2-[(5-phenyl-1,2,4-oxadiazol-3-yl)methylamino]phenyl]acetamide
PubChem CID71977869
Molecular FormulaC19H20N4O2
Molecular Weight336.40 g/mol
Exact Mass336.16
IUPAC NameN,N-dimethyl-2-[2-[(5-phenyl-1,2,4-oxadiazol-3-yl)methylamino]phenyl]acetamide
SMILESCN(C)C(=O)Cc1ccccc1NCc1noc(-c2ccccc2)n1
InChIInChI=1S/C19H20N4O2/c1-23(2)18(24)12-15-10-6-7-11-16(15)20-13-17-21-19(25-22-17)14-8-4-3-5-9-14/h3-11,20H,12-13H2,1-2H3
InChIKeyRLYAMNAQFVZDMF-UHFFFAOYSA-N
XLogP2.98
TPSA71.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[2-[(5-phenyl-1,2,4-oxadiazol-3-yl)methylamino]phenyl]acetamide?
The IUPAC name of N,N-dimethyl-2-[2-[(5-phenyl-1,2,4-oxadiazol-3-yl)methylamino]phenyl]acetamide (CID 71977869) is N,N-dimethyl-2-[2-[(5-phenyl-1,2,4-oxadiazol-3-yl)methylamino]phenyl]acetamide.
What is the SMILES notation for N,N-dimethyl-2-[2-[(5-phenyl-1,2,4-oxadiazol-3-yl)methylamino]phenyl]acetamide?
The canonical SMILES for N,N-dimethyl-2-[2-[(5-phenyl-1,2,4-oxadiazol-3-yl)methylamino]phenyl]acetamide is CN(C)C(=O)Cc1ccccc1NCc1noc(-c2ccccc2)n1.
What is the InChIKey of N,N-dimethyl-2-[2-[(5-phenyl-1,2,4-oxadiazol-3-yl)methylamino]phenyl]acetamide?
The InChIKey is RLYAMNAQFVZDMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O2/c1-23(2)18(24)12-15-10-6-7-11-16(15)20-13-17-21-19(25-22-17)14-8-4-3-5-9-14/h3-11,20H,12-13H2,1-2H3.
What are the key properties of N,N-dimethyl-2-[2-[(5-phenyl-1,2,4-oxadiazol-3-yl)methylamino]phenyl]acetamide?
N,N-dimethyl-2-[2-[(5-phenyl-1,2,4-oxadiazol-3-yl)methylamino]phenyl]acetamide has a molecular weight of 336.40 g/mol, XLogP of 2.98, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[2-[(5-phenyl-1,2,4-oxadiazol-3-yl)methylamino]phenyl]acetamide is sourced from PubChem (CID 71977869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).