N-(1-phenylethyl)-5-(quinolin-8-ylamino)pyrazine-2-carboxamide

C22H19N5O — CID 109280869

IUPACN-(1-phenylethyl)-5-(quinolin-8-ylamino)pyrazine-2-carboxamide
SMILESCC(NC(=O)c1cnc(Nc2cccc3cccnc23)cn1)c1ccccc1
InChIInChI=1S/C22H19N5O/c1-15(16-7-3-2-4-8-16)26-22(28)19-13-25-20(14-24-19)27-18-11-5-9-17-10-6-12-23-21(17)18/h2-15H,1H3,(H,25,27)(H,26,28)
InChIKeyLPRJZMVFGUZZQR-UHFFFAOYSA-N
MW369.43 g/mol
LogP4.26
Rot. Bonds5

About N-(1-phenylethyl)-5-(quinolin-8-ylamino)pyrazine-2-carboxamide

N-(1-phenylethyl)-5-(quinolin-8-ylamino)pyrazine-2-carboxamide (PubChem CID 109280869) has the molecular formula C22H19N5O and a molecular weight of 369.43 g/mol. Its IUPAC name is N-(1-phenylethyl)-5-(quinolin-8-ylamino)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(1-phenylethyl)-5-(quinolin-8-ylamino)pyrazine-2-carboxamide
PubChem CID109280869
Molecular FormulaC22H19N5O
Molecular Weight369.43 g/mol
Exact Mass369.16
IUPAC NameN-(1-phenylethyl)-5-(quinolin-8-ylamino)pyrazine-2-carboxamide
SMILESCC(NC(=O)c1cnc(Nc2cccc3cccnc23)cn1)c1ccccc1
InChIInChI=1S/C22H19N5O/c1-15(16-7-3-2-4-8-16)26-22(28)19-13-25-20(14-24-19)27-18-11-5-9-17-10-6-12-23-21(17)18/h2-15H,1H3,(H,25,27)(H,26,28)
InChIKeyLPRJZMVFGUZZQR-UHFFFAOYSA-N
XLogP4.26
TPSA79.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.43
LogP ≤ 54.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-propan-2-yl-5-(quinolin-8-ylamino)pyrazine-2-carboxamide
CID 109271325
5-(2-methylanilino)-N-(1-phenylethyl)pyrazine-2-carboxamide
CID 109280804
N-(1-phenylethyl)-5-(2-propan-2-ylanilino)pyrazine-2-carboxamide
CID 109280820
N-(2-methoxyphenyl)-5-(quinolin-8-ylamino)pyrazine-2-carboxamide
CID 109293403
N-(1-phenylethyl)quinoline-8-carboxamide
CID 51180563
5-(2,4-difluoroanilino)-N-(1-phenylethyl)pyrazine-2-carboxamide
CID 109280871
5-(2-ethylanilino)-N-quinolin-8-ylpyrazine-2-carboxamide
CID 109291574
5-(5-chloro-2-methylanilino)-N-(1-phenylethyl)pyrazine-2-carboxamide
CID 109280832
5-N-(1-phenylethyl)-3-N-quinolin-8-ylpyridine-3,5-dicarboxamide
CID 109105406
5-(4-fluoroanilino)-N-(1-phenylethyl)pyrazine-2-carboxamide
CID 109280827
5-(3-acetylanilino)-N-(1-phenylethyl)pyrazine-2-carboxamide
CID 109280854
5-(2,6-dimethylanilino)-N-quinolin-8-ylpyrazine-2-carboxamide
CID 109291330

Frequently Asked Questions

What is the IUPAC name of N-(1-phenylethyl)-5-(quinolin-8-ylamino)pyrazine-2-carboxamide?
The IUPAC name of N-(1-phenylethyl)-5-(quinolin-8-ylamino)pyrazine-2-carboxamide (CID 109280869) is N-(1-phenylethyl)-5-(quinolin-8-ylamino)pyrazine-2-carboxamide.
What is the SMILES notation for N-(1-phenylethyl)-5-(quinolin-8-ylamino)pyrazine-2-carboxamide?
The canonical SMILES for N-(1-phenylethyl)-5-(quinolin-8-ylamino)pyrazine-2-carboxamide is CC(NC(=O)c1cnc(Nc2cccc3cccnc23)cn1)c1ccccc1.
What is the InChIKey of N-(1-phenylethyl)-5-(quinolin-8-ylamino)pyrazine-2-carboxamide?
The InChIKey is LPRJZMVFGUZZQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N5O/c1-15(16-7-3-2-4-8-16)26-22(28)19-13-25-20(14-24-19)27-18-11-5-9-17-10-6-12-23-21(17)18/h2-15H,1H3,(H,25,27)(H,26,28).
What are the key properties of N-(1-phenylethyl)-5-(quinolin-8-ylamino)pyrazine-2-carboxamide?
N-(1-phenylethyl)-5-(quinolin-8-ylamino)pyrazine-2-carboxamide has a molecular weight of 369.43 g/mol, XLogP of 4.26, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-phenylethyl)-5-(quinolin-8-ylamino)pyrazine-2-carboxamide is sourced from PubChem (CID 109280869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).