2,5-dichloro-N-[2-oxo-2-(1-pyrazin-2-ylpropan-2-ylamino)ethyl]benzamide

C16H16Cl2N4O2 — CID 91782726

IUPAC2,5-dichloro-N-[2-oxo-2-(1-pyrazin-2-ylpropan-2-ylamino)ethyl]benzamide
SMILESCC(Cc1cnccn1)NC(=O)CNC(=O)c1cc(Cl)ccc1Cl
InChIInChI=1S/C16H16Cl2N4O2/c1-10(6-12-8-19-4-5-20-12)22-15(23)9-21-16(24)13-7-11(17)2-3-14(13)18/h2-5,7-8,10H,6,9H2,1H3,(H,21,24)(H,22,23)
InChIKeyPUFNDRBLTXCPPD-UHFFFAOYSA-N
MW367.24 g/mol
LogP2.26
Rot. Bonds6

About 2,5-dichloro-N-[2-oxo-2-(1-pyrazin-2-ylpropan-2-ylamino)ethyl]benzamide

2,5-dichloro-N-[2-oxo-2-(1-pyrazin-2-ylpropan-2-ylamino)ethyl]benzamide (PubChem CID 91782726) has the molecular formula C16H16Cl2N4O2 and a molecular weight of 367.24 g/mol. Its IUPAC name is 2,5-dichloro-N-[2-oxo-2-(1-pyrazin-2-ylpropan-2-ylamino)ethyl]benzamide.

Molecular Properties

Compound Name2,5-dichloro-N-[2-oxo-2-(1-pyrazin-2-ylpropan-2-ylamino)ethyl]benzamide
PubChem CID91782726
Molecular FormulaC16H16Cl2N4O2
Molecular Weight367.24 g/mol
Exact Mass366.07
IUPAC Name2,5-dichloro-N-[2-oxo-2-(1-pyrazin-2-ylpropan-2-ylamino)ethyl]benzamide
SMILESCC(Cc1cnccn1)NC(=O)CNC(=O)c1cc(Cl)ccc1Cl
InChIInChI=1S/C16H16Cl2N4O2/c1-10(6-12-8-19-4-5-20-12)22-15(23)9-21-16(24)13-7-11(17)2-3-14(13)18/h2-5,7-8,10H,6,9H2,1H3,(H,21,24)(H,22,23)
InChIKeyPUFNDRBLTXCPPD-UHFFFAOYSA-N
XLogP2.26
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.24
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

CID 123415418
CID 123415418
3-[[2-[(2,5-dichlorobenzoyl)amino]acetyl]amino]-4-methylpentanoic acid
CID 91795654
N-[2-[[(2R)-butan-2-yl]amino]-2-oxoethyl]-2,4-dichlorobenzamide
CID 8852436
2,5-dichloro-N-[2-[[(1R)-1-dimethylboranyl-3-methylbutyl]amino]-2-oxoethyl]benzamide
CID 59441524
2,4-dichloro-N-[2-oxo-2-(1-pyridin-3-ylethylamino)ethyl]benzamide
CID 51193025
5-chloro-2-hydroxy-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide
CID 43402430
1-[(3-chlorophenyl)methyl]-N-(1-pyrazin-2-ylpropan-2-yl)triazole-4-carboxamide
CID 45200047
2,4-dichloro-N-[2-[1-(3,4-dichlorophenyl)ethylamino]-2-oxoethyl]benzamide
CID 55350113
2,5-dichloro-N-[(2R)-2-hydroxypropyl]benzamide
CID 83031874
2,5-dichloro-N-(1-pyridin-3-ylethyl)benzamide
CID 18168780
5-methyl-N-(1-pyrazin-2-ylpropan-2-yl)pyrazine-2-carboxamide
CID 91779730
[[2-[(2,5-dichlorobenzoyl)amino]acetyl]amino]methylboronic acid
CID 142284164

Frequently Asked Questions

What is the IUPAC name of 2,5-dichloro-N-[2-oxo-2-(1-pyrazin-2-ylpropan-2-ylamino)ethyl]benzamide?
The IUPAC name of 2,5-dichloro-N-[2-oxo-2-(1-pyrazin-2-ylpropan-2-ylamino)ethyl]benzamide (CID 91782726) is 2,5-dichloro-N-[2-oxo-2-(1-pyrazin-2-ylpropan-2-ylamino)ethyl]benzamide.
What is the SMILES notation for 2,5-dichloro-N-[2-oxo-2-(1-pyrazin-2-ylpropan-2-ylamino)ethyl]benzamide?
The canonical SMILES for 2,5-dichloro-N-[2-oxo-2-(1-pyrazin-2-ylpropan-2-ylamino)ethyl]benzamide is CC(Cc1cnccn1)NC(=O)CNC(=O)c1cc(Cl)ccc1Cl.
What is the InChIKey of 2,5-dichloro-N-[2-oxo-2-(1-pyrazin-2-ylpropan-2-ylamino)ethyl]benzamide?
The InChIKey is PUFNDRBLTXCPPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16Cl2N4O2/c1-10(6-12-8-19-4-5-20-12)22-15(23)9-21-16(24)13-7-11(17)2-3-14(13)18/h2-5,7-8,10H,6,9H2,1H3,(H,21,24)(H,22,23).
What are the key properties of 2,5-dichloro-N-[2-oxo-2-(1-pyrazin-2-ylpropan-2-ylamino)ethyl]benzamide?
2,5-dichloro-N-[2-oxo-2-(1-pyrazin-2-ylpropan-2-ylamino)ethyl]benzamide has a molecular weight of 367.24 g/mol, XLogP of 2.26, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dichloro-N-[2-oxo-2-(1-pyrazin-2-ylpropan-2-ylamino)ethyl]benzamide is sourced from PubChem (CID 91782726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).