5-(2,4-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide

C17H19Cl2N5O2 — CID 109277582

IUPAC5-(2,4-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide
SMILESO=C(NCCN1CCOCC1)c1cnc(Nc2ccc(Cl)cc2Cl)cn1
InChIInChI=1S/C17H19Cl2N5O2/c18-12-1-2-14(13(19)9-12)23-16-11-21-15(10-22-16)17(25)20-3-4-24-5-7-26-8-6-24/h1-2,9-11H,3-8H2,(H,20,25)(H,22,23)
InChIKeyRTRYEIWVIPMXLP-UHFFFAOYSA-N
MW396.28 g/mol
LogP2.59
Rot. Bonds6

About 5-(2,4-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide

5-(2,4-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide (PubChem CID 109277582) has the molecular formula C17H19Cl2N5O2 and a molecular weight of 396.28 g/mol. Its IUPAC name is 5-(2,4-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(2,4-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide
PubChem CID109277582
Molecular FormulaC17H19Cl2N5O2
Molecular Weight396.28 g/mol
Exact Mass395.09
IUPAC Name5-(2,4-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide
SMILESO=C(NCCN1CCOCC1)c1cnc(Nc2ccc(Cl)cc2Cl)cn1
InChIInChI=1S/C17H19Cl2N5O2/c18-12-1-2-14(13(19)9-12)23-16-11-21-15(10-22-16)17(25)20-3-4-24-5-7-26-8-6-24/h1-2,9-11H,3-8H2,(H,20,25)(H,22,23)
InChIKeyRTRYEIWVIPMXLP-UHFFFAOYSA-N
XLogP2.59
TPSA79.38 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.28
LogP ≤ 52.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5-(3-chloro-2-methylanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide
CID 109277542
5-[(4-chlorophenyl)methylamino]-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide
CID 109277474
N-(2-morpholin-4-ylethyl)-5-(2-morpholin-4-ylethylamino)pyrazine-2-carboxamide
CID 109277458
5-(2-methoxyanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide
CID 109277550
5-(methylamino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide
CID 107374273
5-(4-cyanoanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide
CID 109277590
N-(2,4-dichlorophenyl)-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide
CID 109154085
5-(2,6-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
CID 109185766
2,4-dichloro-N-[4-chloro-2-(2-morpholin-4-ylethylcarbamoyl)phenyl]benzamide
CID 991469
5-(3-methoxypropylamino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide
CID 109276207
6-(3-chloro-4-fluoroanilino)-N-(2-morpholin-4-ylethyl)pyrimidine-4-carboxamide
CID 109344634
N-(2-morpholin-4-ylethyl)-5-(pyridin-3-ylmethylamino)pyrazine-2-carboxamide
CID 109277480

Frequently Asked Questions

What is the IUPAC name of 5-(2,4-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide?
The IUPAC name of 5-(2,4-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide (CID 109277582) is 5-(2,4-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-(2,4-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide?
The canonical SMILES for 5-(2,4-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide is O=C(NCCN1CCOCC1)c1cnc(Nc2ccc(Cl)cc2Cl)cn1.
What is the InChIKey of 5-(2,4-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide?
The InChIKey is RTRYEIWVIPMXLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19Cl2N5O2/c18-12-1-2-14(13(19)9-12)23-16-11-21-15(10-22-16)17(25)20-3-4-24-5-7-26-8-6-24/h1-2,9-11H,3-8H2,(H,20,25)(H,22,23).
What are the key properties of 5-(2,4-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide?
5-(2,4-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide has a molecular weight of 396.28 g/mol, XLogP of 2.59, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,4-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide is sourced from PubChem (CID 109277582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).