5-(2,5-dichloroanilino)-N,N-dipropylpyrazine-2-carboxamide

C17H20Cl2N4O — CID 109288990

IUPAC5-(2,5-dichloroanilino)-N,N-dipropylpyrazine-2-carboxamide
SMILESCCCN(CCC)C(=O)c1cnc(Nc2cc(Cl)ccc2Cl)cn1
InChIInChI=1S/C17H20Cl2N4O/c1-3-7-23(8-4-2)17(24)15-10-21-16(11-20-15)22-14-9-12(18)5-6-13(14)19/h5-6,9-11H,3-4,7-8H2,1-2H3,(H,21,22)
InChIKeyNDGGHOQABBFLCQ-UHFFFAOYSA-N
MW367.28 g/mol
LogP4.79
Rot. Bonds7

About 5-(2,5-dichloroanilino)-N,N-dipropylpyrazine-2-carboxamide

5-(2,5-dichloroanilino)-N,N-dipropylpyrazine-2-carboxamide (PubChem CID 109288990) has the molecular formula C17H20Cl2N4O and a molecular weight of 367.28 g/mol. Its IUPAC name is 5-(2,5-dichloroanilino)-N,N-dipropylpyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(2,5-dichloroanilino)-N,N-dipropylpyrazine-2-carboxamide
PubChem CID109288990
Molecular FormulaC17H20Cl2N4O
Molecular Weight367.28 g/mol
Exact Mass366.10
IUPAC Name5-(2,5-dichloroanilino)-N,N-dipropylpyrazine-2-carboxamide
SMILESCCCN(CCC)C(=O)c1cnc(Nc2cc(Cl)ccc2Cl)cn1
InChIInChI=1S/C17H20Cl2N4O/c1-3-7-23(8-4-2)17(24)15-10-21-16(11-20-15)22-14-9-12(18)5-6-13(14)19/h5-6,9-11H,3-4,7-8H2,1-2H3,(H,21,22)
InChIKeyNDGGHOQABBFLCQ-UHFFFAOYSA-N
XLogP4.79
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.28
LogP ≤ 54.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(4-chloro-2-methylanilino)-N,N-dipropylpyrazine-2-carboxamide
CID 109288935
5-(2,4-dichloroanilino)-N,N-diethylpyrazine-2-carboxamide
CID 109286836
N,N-dipropyl-5-(2,3,4-trifluoroanilino)pyrazine-2-carboxamide
CID 109289002
5-[2-(4-chlorophenyl)ethylamino]-N,N-dipropylpyrazine-2-carboxamide
CID 109285830
5-(4-propan-2-ylanilino)-N,N-dipropylpyrazine-2-carboxamide
CID 109288923
N-butyl-5-(4-chloro-2-methylanilino)-N-methylpyrazine-2-carboxamide
CID 109288269
5-(2,5-dichloroanilino)-N-(pyridin-4-ylmethyl)pyrazine-2-carboxamide
CID 109283625
5-(2,5-dichloroanilino)-N-(2-methylphenyl)pyrazine-2-carboxamide
CID 109289712
5-(2,3-dichloroanilino)-N,N-diethylpyrazine-2-carboxamide
CID 109286840
5-(4-bromo-3-methylanilino)-N,N-dipropylpyrazine-2-carboxamide
CID 109288979
5-(2,5-dichloroanilino)-N-(2-fluorophenyl)pyrazine-2-carboxamide
CID 109292385
5-(3-chloro-4-fluoroanilino)-N,N-dipropylpyridine-2-carboxamide
CID 109196558

Frequently Asked Questions

What is the IUPAC name of 5-(2,5-dichloroanilino)-N,N-dipropylpyrazine-2-carboxamide?
The IUPAC name of 5-(2,5-dichloroanilino)-N,N-dipropylpyrazine-2-carboxamide (CID 109288990) is 5-(2,5-dichloroanilino)-N,N-dipropylpyrazine-2-carboxamide.
What is the SMILES notation for 5-(2,5-dichloroanilino)-N,N-dipropylpyrazine-2-carboxamide?
The canonical SMILES for 5-(2,5-dichloroanilino)-N,N-dipropylpyrazine-2-carboxamide is CCCN(CCC)C(=O)c1cnc(Nc2cc(Cl)ccc2Cl)cn1.
What is the InChIKey of 5-(2,5-dichloroanilino)-N,N-dipropylpyrazine-2-carboxamide?
The InChIKey is NDGGHOQABBFLCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20Cl2N4O/c1-3-7-23(8-4-2)17(24)15-10-21-16(11-20-15)22-14-9-12(18)5-6-13(14)19/h5-6,9-11H,3-4,7-8H2,1-2H3,(H,21,22).
What are the key properties of 5-(2,5-dichloroanilino)-N,N-dipropylpyrazine-2-carboxamide?
5-(2,5-dichloroanilino)-N,N-dipropylpyrazine-2-carboxamide has a molecular weight of 367.28 g/mol, XLogP of 4.79, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,5-dichloroanilino)-N,N-dipropylpyrazine-2-carboxamide is sourced from PubChem (CID 109288990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).