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

C19H21N5O3 — CID 118790425

IUPACN-ethyl-N-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-3-(3-methoxypyrazin-2-yl)benzamide
SMILESCCc1noc(CN(CC)C(=O)c2cccc(-c3nccnc3OC)c2)n1
InChIInChI=1S/C19H21N5O3/c1-4-15-22-16(27-23-15)12-24(5-2)19(25)14-8-6-7-13(11-14)17-18(26-3)21-10-9-20-17/h6-11H,4-5,12H2,1-3H3
InChIKeyJRRIIOBVIVCWQC-UHFFFAOYSA-N
MW367.41 g/mol
LogP2.76
Rot. Bonds7

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

N-ethyl-N-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-3-(3-methoxypyrazin-2-yl)benzamide (PubChem CID 118790425) has the molecular formula C19H21N5O3 and a molecular weight of 367.41 g/mol. Its IUPAC name is N-ethyl-N-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-3-(3-methoxypyrazin-2-yl)benzamide.

Molecular Properties

Compound NameN-ethyl-N-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-3-(3-methoxypyrazin-2-yl)benzamide
PubChem CID118790425
Molecular FormulaC19H21N5O3
Molecular Weight367.41 g/mol
Exact Mass367.16
IUPAC NameN-ethyl-N-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-3-(3-methoxypyrazin-2-yl)benzamide
SMILESCCc1noc(CN(CC)C(=O)c2cccc(-c3nccnc3OC)c2)n1
InChIInChI=1S/C19H21N5O3/c1-4-15-22-16(27-23-15)12-24(5-2)19(25)14-8-6-7-13(11-14)17-18(26-3)21-10-9-20-17/h6-11H,4-5,12H2,1-3H3
InChIKeyJRRIIOBVIVCWQC-UHFFFAOYSA-N
XLogP2.76
TPSA94.24 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.41
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

N-[[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-ethyl-3-methylbenzamide
CID 6494655
3-(3-methoxypyrazin-2-yl)-N-methyl-N-(1-pyrazin-2-ylpropan-2-yl)benzamide
CID 118772615
N-[[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-ethyl-3-propan-2-yloxybenzamide
CID 8779231
N-[(1S)-1-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-3-(3-methoxypyrazin-2-yl)-N-methylbenzamide
CID 125173964
N-ethyl-2-methoxy-N-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]benzamide
CID 8835940
N-ethyl-3-(3-methoxyphenyl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-1H-pyrazole-5-carboxamide
CID 70760439
N-[[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-ethyl-4-methoxybenzamide
CID 6494677
N-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-2,4,5-trimethoxy-N-methylbenzamide
CID 52886359
1-(difluoromethyl)-N-ethyl-N-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]pyrazole-3-carboxamide
CID 91795608
4-(2,4-dioxoimidazolidin-1-yl)-N-ethyl-N-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]benzamide
CID 72896150
N-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-ethyl-2,6-dimethoxybenzamide
CID 6494839
N-ethyl-N-[[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-4-propoxybenzamide
CID 8778966

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-3-(3-methoxypyrazin-2-yl)benzamide?
The IUPAC name of N-ethyl-N-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-3-(3-methoxypyrazin-2-yl)benzamide (CID 118790425) is N-ethyl-N-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-3-(3-methoxypyrazin-2-yl)benzamide.
What is the SMILES notation for N-ethyl-N-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-3-(3-methoxypyrazin-2-yl)benzamide?
The canonical SMILES for N-ethyl-N-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-3-(3-methoxypyrazin-2-yl)benzamide is CCc1noc(CN(CC)C(=O)c2cccc(-c3nccnc3OC)c2)n1.
What is the InChIKey of N-ethyl-N-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-3-(3-methoxypyrazin-2-yl)benzamide?
The InChIKey is JRRIIOBVIVCWQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O3/c1-4-15-22-16(27-23-15)12-24(5-2)19(25)14-8-6-7-13(11-14)17-18(26-3)21-10-9-20-17/h6-11H,4-5,12H2,1-3H3.
What are the key properties of N-ethyl-N-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-3-(3-methoxypyrazin-2-yl)benzamide?
N-ethyl-N-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-3-(3-methoxypyrazin-2-yl)benzamide has a molecular weight of 367.41 g/mol, XLogP of 2.76, 7 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-3-(3-methoxypyrazin-2-yl)benzamide is sourced from PubChem (CID 118790425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).