5-(4-cyanoanilino)-N-propylpyrazine-2-carboxamide

C15H15N5O — CID 109270948

IUPAC5-(4-cyanoanilino)-N-propylpyrazine-2-carboxamide
SMILESCCCNC(=O)c1cnc(Nc2ccc(C#N)cc2)cn1
InChIInChI=1S/C15H15N5O/c1-2-7-17-15(21)13-9-19-14(10-18-13)20-12-5-3-11(8-16)4-6-12/h3-6,9-10H,2,7H2,1H3,(H,17,21)(H,19,20)
InChIKeyFHHSFKPRZZGUBN-UHFFFAOYSA-N
MW281.32 g/mol
LogP2.23
Rot. Bonds5

About 5-(4-cyanoanilino)-N-propylpyrazine-2-carboxamide

5-(4-cyanoanilino)-N-propylpyrazine-2-carboxamide (PubChem CID 109270948) has the molecular formula C15H15N5O and a molecular weight of 281.32 g/mol. Its IUPAC name is 5-(4-cyanoanilino)-N-propylpyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(4-cyanoanilino)-N-propylpyrazine-2-carboxamide
PubChem CID109270948
Molecular FormulaC15H15N5O
Molecular Weight281.32 g/mol
Exact Mass281.13
IUPAC Name5-(4-cyanoanilino)-N-propylpyrazine-2-carboxamide
SMILESCCCNC(=O)c1cnc(Nc2ccc(C#N)cc2)cn1
InChIInChI=1S/C15H15N5O/c1-2-7-17-15(21)13-9-19-14(10-18-13)20-12-5-3-11(8-16)4-6-12/h3-6,9-10H,2,7H2,1H3,(H,17,21)(H,19,20)
InChIKeyFHHSFKPRZZGUBN-UHFFFAOYSA-N
XLogP2.23
TPSA90.70 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.32
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(4-cyanoanilino)-N-propylpyridine-2-carboxamide
CID 109179230
6-(4-cyanoanilino)-N-propylpyrimidine-4-carboxamide
CID 109338626
N-(4-cyanophenyl)-5-(propylamino)pyrazine-2-carboxamide
CID 109271147
5-(4-cyanoanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide
CID 109277590
N-butyl-5-(4-cyanoanilino)-N-methylpyrazine-2-carboxamide
CID 109288338
5-(4-cyanoanilino)-N-pentylpyridine-2-carboxamide
CID 109195813
N-(4-acetylphenyl)-5-(4-cyanoanilino)pyrazine-2-carboxamide
CID 109294086
N-butyl-6-(4-cyanoanilino)pyridazine-3-carboxamide
CID 109110955
N-(3-acetylphenyl)-5-(4-cyanoanilino)pyrazine-2-carboxamide
CID 109294044
4-[[5-(pyrrolidine-1-carbonyl)pyrazin-2-yl]amino]benzonitrile
CID 109273685
N-[2-(dimethylamino)ethyl]-5-(4-methylanilino)pyrazine-2-carboxamide
CID 109277174
6-(4-cyanoanilino)-N-[3-(dimethylamino)propyl]pyridine-3-carboxamide
CID 109154528

Frequently Asked Questions

What is the IUPAC name of 5-(4-cyanoanilino)-N-propylpyrazine-2-carboxamide?
The IUPAC name of 5-(4-cyanoanilino)-N-propylpyrazine-2-carboxamide (CID 109270948) is 5-(4-cyanoanilino)-N-propylpyrazine-2-carboxamide.
What is the SMILES notation for 5-(4-cyanoanilino)-N-propylpyrazine-2-carboxamide?
The canonical SMILES for 5-(4-cyanoanilino)-N-propylpyrazine-2-carboxamide is CCCNC(=O)c1cnc(Nc2ccc(C#N)cc2)cn1.
What is the InChIKey of 5-(4-cyanoanilino)-N-propylpyrazine-2-carboxamide?
The InChIKey is FHHSFKPRZZGUBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5O/c1-2-7-17-15(21)13-9-19-14(10-18-13)20-12-5-3-11(8-16)4-6-12/h3-6,9-10H,2,7H2,1H3,(H,17,21)(H,19,20).
What are the key properties of 5-(4-cyanoanilino)-N-propylpyrazine-2-carboxamide?
5-(4-cyanoanilino)-N-propylpyrazine-2-carboxamide has a molecular weight of 281.32 g/mol, XLogP of 2.23, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-cyanoanilino)-N-propylpyrazine-2-carboxamide is sourced from PubChem (CID 109270948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).