N-(2,6-dichlorophenyl)-2-[methyl-[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]acetamide

C17H20Cl2N4O2 — CID 133424150

IUPACN-(2,6-dichlorophenyl)-2-[methyl-[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]acetamide
SMILESCC(C)Cn1ccnc(N(C)CC(=O)Nc2c(Cl)cccc2Cl)c1=O
InChIInChI=1S/C17H20Cl2N4O2/c1-11(2)9-23-8-7-20-16(17(23)25)22(3)10-14(24)21-15-12(18)5-4-6-13(15)19/h4-8,11H,9-10H2,1-3H3,(H,21,24)
InChIKeyHRYFUSSAAGZQHK-UHFFFAOYSA-N
MW383.28 g/mol
LogP3.28
Rot. Bonds6

About N-(2,6-dichlorophenyl)-2-[methyl-[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]acetamide

N-(2,6-dichlorophenyl)-2-[methyl-[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]acetamide (PubChem CID 133424150) has the molecular formula C17H20Cl2N4O2 and a molecular weight of 383.28 g/mol. Its IUPAC name is N-(2,6-dichlorophenyl)-2-[methyl-[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]acetamide.

Molecular Properties

Compound NameN-(2,6-dichlorophenyl)-2-[methyl-[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]acetamide
PubChem CID133424150
Molecular FormulaC17H20Cl2N4O2
Molecular Weight383.28 g/mol
Exact Mass382.10
IUPAC NameN-(2,6-dichlorophenyl)-2-[methyl-[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]acetamide
SMILESCC(C)Cn1ccnc(N(C)CC(=O)Nc2c(Cl)cccc2Cl)c1=O
InChIInChI=1S/C17H20Cl2N4O2/c1-11(2)9-23-8-7-20-16(17(23)25)22(3)10-14(24)21-15-12(18)5-4-6-13(15)19/h4-8,11H,9-10H2,1-3H3,(H,21,24)
InChIKeyHRYFUSSAAGZQHK-UHFFFAOYSA-N
XLogP3.28
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.28
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[methyl-[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]acetamide
CID 71910064
3-[2-bromoethyl(methyl)amino]-1-(2-methylpropyl)pyrazin-2-one
CID 80676762
N-(2,6-dichlorophenyl)-2-(dimethylamino)acetamide
CID 9255062
2-[(5-chloro-6-oxo-1H-pyridazin-4-yl)-methylamino]-N-(2,6-dichlorophenyl)acetamide
CID 154859378
2-[tert-butyl-[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]acetic acid
CID 79268738
N-(2,6-dichlorophenyl)-2-[methyl(thieno[2,3-d]pyrimidin-4-yl)amino]acetamide
CID 9195570
N-(2,6-dichlorophenyl)-2-[1-hydroxypropan-2-yl(methyl)amino]acetamide
CID 112706093
N-(2,6-dichlorophenyl)-3-methylbutanamide
CID 849070
2-[acetyl(1-phenylethyl)amino]-N-(2,6-dichlorophenyl)acetamide
CID 113162118
2-[(4-ethyl-3-oxopyrazin-2-yl)-methylamino]-N-(4-morpholin-4-ylphenyl)acetamide
CID 133447108
N-(2,6-dichlorophenyl)-2-[methyl-[2-[[(2S)-3-methylbutan-2-yl]amino]-2-oxoethyl]amino]acetamide
CID 8559545
N-(2,6-dichlorophenyl)-2-[methyl-[2-[[(2R)-3-methylbutan-2-yl]amino]-2-oxoethyl]amino]acetamide
CID 8559536

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dichlorophenyl)-2-[methyl-[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]acetamide?
The IUPAC name of N-(2,6-dichlorophenyl)-2-[methyl-[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]acetamide (CID 133424150) is N-(2,6-dichlorophenyl)-2-[methyl-[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]acetamide.
What is the SMILES notation for N-(2,6-dichlorophenyl)-2-[methyl-[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]acetamide?
The canonical SMILES for N-(2,6-dichlorophenyl)-2-[methyl-[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]acetamide is CC(C)Cn1ccnc(N(C)CC(=O)Nc2c(Cl)cccc2Cl)c1=O.
What is the InChIKey of N-(2,6-dichlorophenyl)-2-[methyl-[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]acetamide?
The InChIKey is HRYFUSSAAGZQHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20Cl2N4O2/c1-11(2)9-23-8-7-20-16(17(23)25)22(3)10-14(24)21-15-12(18)5-4-6-13(15)19/h4-8,11H,9-10H2,1-3H3,(H,21,24).
What are the key properties of N-(2,6-dichlorophenyl)-2-[methyl-[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]acetamide?
N-(2,6-dichlorophenyl)-2-[methyl-[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]acetamide has a molecular weight of 383.28 g/mol, XLogP of 3.28, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dichlorophenyl)-2-[methyl-[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]acetamide is sourced from PubChem (CID 133424150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).