5-(methylamino)-N-(4-propoxyphenyl)pyrazine-2-carboxamide

C15H18N4O2 — CID 107375410

IUPAC5-(methylamino)-N-(4-propoxyphenyl)pyrazine-2-carboxamide
SMILESCCCOc1ccc(NC(=O)c2cnc(NC)cn2)cc1
InChIInChI=1S/C15H18N4O2/c1-3-8-21-12-6-4-11(5-7-12)19-15(20)13-9-18-14(16-2)10-17-13/h4-7,9-10H,3,8H2,1-2H3,(H,16,18)(H,19,20)
InChIKeyASBAEJCMFZWEDO-UHFFFAOYSA-N
MW286.34 g/mol
LogP2.56
Rot. Bonds6

About 5-(methylamino)-N-(4-propoxyphenyl)pyrazine-2-carboxamide

5-(methylamino)-N-(4-propoxyphenyl)pyrazine-2-carboxamide (PubChem CID 107375410) has the molecular formula C15H18N4O2 and a molecular weight of 286.34 g/mol. Its IUPAC name is 5-(methylamino)-N-(4-propoxyphenyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(methylamino)-N-(4-propoxyphenyl)pyrazine-2-carboxamide
PubChem CID107375410
Molecular FormulaC15H18N4O2
Molecular Weight286.34 g/mol
Exact Mass286.14
IUPAC Name5-(methylamino)-N-(4-propoxyphenyl)pyrazine-2-carboxamide
SMILESCCCOc1ccc(NC(=O)c2cnc(NC)cn2)cc1
InChIInChI=1S/C15H18N4O2/c1-3-8-21-12-6-4-11(5-7-12)19-15(20)13-9-18-14(16-2)10-17-13/h4-7,9-10H,3,8H2,1-2H3,(H,16,18)(H,19,20)
InChIKeyASBAEJCMFZWEDO-UHFFFAOYSA-N
XLogP2.56
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.34
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-bromo-N-(4-propoxyphenyl)pyridine-2-carboxamide
CID 62953584
N-(4-bromophenyl)-5-(methylamino)pyrazine-2-carboxamide
CID 107374238
5-(4-ethoxyanilino)-N-phenylpyrazine-2-carboxamide
CID 109289463
N-(4-ethoxyphenyl)-5-(4-methoxyanilino)pyrazine-2-carboxamide
CID 109293614
5-(methylamino)-N-pyridin-4-ylpyrazine-2-carboxamide
CID 107374325
N-[4-(dimethylamino)phenyl]-5-(4-ethoxyanilino)pyrazine-2-carboxamide
CID 109293760
N-(4-propoxyphenyl)-1H-pyrazole-4-carboxamide
CID 62328004
N-(4-ethoxyphenyl)-5-(methylamino)pyridine-2-carboxamide
CID 104639683
5-(2,3-dimethylanilino)-N-(4-ethoxyphenyl)pyrazine-2-carboxamide
CID 109291428
5-hydrazinyl-N-(4-methoxyphenyl)pyrazine-2-carboxamide
CID 107377590
6-fluoro-N-(4-propoxyphenyl)pyridine-2-carboxamide
CID 115497769
3-chloro-N-(4-propoxyphenyl)pyridine-4-carboxamide
CID 66483370

Frequently Asked Questions

What is the IUPAC name of 5-(methylamino)-N-(4-propoxyphenyl)pyrazine-2-carboxamide?
The IUPAC name of 5-(methylamino)-N-(4-propoxyphenyl)pyrazine-2-carboxamide (CID 107375410) is 5-(methylamino)-N-(4-propoxyphenyl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-(methylamino)-N-(4-propoxyphenyl)pyrazine-2-carboxamide?
The canonical SMILES for 5-(methylamino)-N-(4-propoxyphenyl)pyrazine-2-carboxamide is CCCOc1ccc(NC(=O)c2cnc(NC)cn2)cc1.
What is the InChIKey of 5-(methylamino)-N-(4-propoxyphenyl)pyrazine-2-carboxamide?
The InChIKey is ASBAEJCMFZWEDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O2/c1-3-8-21-12-6-4-11(5-7-12)19-15(20)13-9-18-14(16-2)10-17-13/h4-7,9-10H,3,8H2,1-2H3,(H,16,18)(H,19,20).
What are the key properties of 5-(methylamino)-N-(4-propoxyphenyl)pyrazine-2-carboxamide?
5-(methylamino)-N-(4-propoxyphenyl)pyrazine-2-carboxamide has a molecular weight of 286.34 g/mol, XLogP of 2.56, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methylamino)-N-(4-propoxyphenyl)pyrazine-2-carboxamide is sourced from PubChem (CID 107375410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).