5-(cyclopropylamino)-N-(2,4-dimethoxyphenyl)pyrazine-2-carboxamide

C16H18N4O3 — CID 109271885

IUPAC5-(cyclopropylamino)-N-(2,4-dimethoxyphenyl)pyrazine-2-carboxamide
SMILESCOc1ccc(NC(=O)c2cnc(NC3CC3)cn2)c(OC)c1
InChIInChI=1S/C16H18N4O3/c1-22-11-5-6-12(14(7-11)23-2)20-16(21)13-8-18-15(9-17-13)19-10-3-4-10/h5-10H,3-4H2,1-2H3,(H,18,19)(H,20,21)
InChIKeyFYZWGERWTRCDNG-UHFFFAOYSA-N
MW314.35 g/mol
LogP2.32
Rot. Bonds6

About 5-(cyclopropylamino)-N-(2,4-dimethoxyphenyl)pyrazine-2-carboxamide

5-(cyclopropylamino)-N-(2,4-dimethoxyphenyl)pyrazine-2-carboxamide (PubChem CID 109271885) has the molecular formula C16H18N4O3 and a molecular weight of 314.35 g/mol. Its IUPAC name is 5-(cyclopropylamino)-N-(2,4-dimethoxyphenyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(cyclopropylamino)-N-(2,4-dimethoxyphenyl)pyrazine-2-carboxamide
PubChem CID109271885
Molecular FormulaC16H18N4O3
Molecular Weight314.35 g/mol
Exact Mass314.14
IUPAC Name5-(cyclopropylamino)-N-(2,4-dimethoxyphenyl)pyrazine-2-carboxamide
SMILESCOc1ccc(NC(=O)c2cnc(NC3CC3)cn2)c(OC)c1
InChIInChI=1S/C16H18N4O3/c1-22-11-5-6-12(14(7-11)23-2)20-16(21)13-8-18-15(9-17-13)19-10-3-4-10/h5-10H,3-4H2,1-2H3,(H,18,19)(H,20,21)
InChIKeyFYZWGERWTRCDNG-UHFFFAOYSA-N
XLogP2.32
TPSA85.37 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.35
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2,5-dimethoxyphenyl)-5-[(1,1-dioxothiolan-3-yl)amino]pyrazine-2-carboxamide
CID 109285300
N-(5-chloro-2-methoxyphenyl)-5-(cycloheptylamino)pyrazine-2-carboxamide
CID 109287599
5-(cyclohexylamino)-N-(4-methoxyphenyl)pyrazine-2-carboxamide
CID 109274938
6-(cyclopropylamino)-N-(2,4-dimethoxyphenyl)-2-phenylpyrimidine-4-carboxamide
CID 112851800
N-(2,4-dimethoxyphenyl)-5-(2-propan-2-ylanilino)pyrazine-2-carboxamide
CID 109291979
5-(4-cyanoanilino)-N-(2,4-dimethoxyphenyl)pyrazine-2-carboxamide
CID 109293927
N-(2,4-dimethoxyphenyl)-5-(3-fluoroanilino)pyrazine-2-carboxamide
CID 109293921
N-(2,5-dimethoxyphenyl)-5-(methylamino)pyrazine-2-carboxamide
CID 107374016
5-(3-acetylanilino)-N-(2,4-dimethoxyphenyl)pyrazine-2-carboxamide
CID 109293918
methyl 4-chloro-3-[[5-(cyclopropylamino)pyrazine-2-carbonyl]amino]benzoate
CID 109271897
N-(2,4-dimethoxyphenyl)-5-(pyridin-3-ylmethylamino)pyrazine-2-carboxamide
CID 109283445
N-(2,4-dimethoxyphenyl)-5-[2-(4-fluorophenyl)ethylamino]pyrazine-2-carboxamide
CID 109284563

Frequently Asked Questions

What is the IUPAC name of 5-(cyclopropylamino)-N-(2,4-dimethoxyphenyl)pyrazine-2-carboxamide?
The IUPAC name of 5-(cyclopropylamino)-N-(2,4-dimethoxyphenyl)pyrazine-2-carboxamide (CID 109271885) is 5-(cyclopropylamino)-N-(2,4-dimethoxyphenyl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-(cyclopropylamino)-N-(2,4-dimethoxyphenyl)pyrazine-2-carboxamide?
The canonical SMILES for 5-(cyclopropylamino)-N-(2,4-dimethoxyphenyl)pyrazine-2-carboxamide is COc1ccc(NC(=O)c2cnc(NC3CC3)cn2)c(OC)c1.
What is the InChIKey of 5-(cyclopropylamino)-N-(2,4-dimethoxyphenyl)pyrazine-2-carboxamide?
The InChIKey is FYZWGERWTRCDNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O3/c1-22-11-5-6-12(14(7-11)23-2)20-16(21)13-8-18-15(9-17-13)19-10-3-4-10/h5-10H,3-4H2,1-2H3,(H,18,19)(H,20,21).
What are the key properties of 5-(cyclopropylamino)-N-(2,4-dimethoxyphenyl)pyrazine-2-carboxamide?
5-(cyclopropylamino)-N-(2,4-dimethoxyphenyl)pyrazine-2-carboxamide has a molecular weight of 314.35 g/mol, XLogP of 2.32, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclopropylamino)-N-(2,4-dimethoxyphenyl)pyrazine-2-carboxamide is sourced from PubChem (CID 109271885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).