6-phenyl-3-[(1-pyrazin-2-ylethylamino)methyl]-5-quinolin-6-ylpyrazin-2-amine

C26H23N7 — CID 154657983

IUPAC6-phenyl-3-[(1-pyrazin-2-ylethylamino)methyl]-5-quinolin-6-ylpyrazin-2-amine
SMILESCC(NCc1nc(-c2ccc3ncccc3c2)c(-c2ccccc2)nc1N)c1cnccn1
InChIInChI=1S/C26H23N7/c1-17(22-15-28-12-13-30-22)31-16-23-26(27)33-24(18-6-3-2-4-7-18)25(32-23)20-9-10-21-19(14-20)8-5-11-29-21/h2-15,17,31H,16H2,1H3,(H2,27,33)
InChIKeyNUNLDHTWNWCSQO-UHFFFAOYSA-N
MW433.52 g/mol
LogP4.58
Rot. Bonds6

About 6-phenyl-3-[(1-pyrazin-2-ylethylamino)methyl]-5-quinolin-6-ylpyrazin-2-amine

6-phenyl-3-[(1-pyrazin-2-ylethylamino)methyl]-5-quinolin-6-ylpyrazin-2-amine (PubChem CID 154657983) has the molecular formula C26H23N7 and a molecular weight of 433.52 g/mol. Its IUPAC name is 6-phenyl-3-[(1-pyrazin-2-ylethylamino)methyl]-5-quinolin-6-ylpyrazin-2-amine.

Molecular Properties

Compound Name6-phenyl-3-[(1-pyrazin-2-ylethylamino)methyl]-5-quinolin-6-ylpyrazin-2-amine
PubChem CID154657983
Molecular FormulaC26H23N7
Molecular Weight433.52 g/mol
Exact Mass433.20
IUPAC Name6-phenyl-3-[(1-pyrazin-2-ylethylamino)methyl]-5-quinolin-6-ylpyrazin-2-amine
SMILESCC(NCc1nc(-c2ccc3ncccc3c2)c(-c2ccccc2)nc1N)c1cnccn1
InChIInChI=1S/C26H23N7/c1-17(22-15-28-12-13-30-22)31-16-23-26(27)33-24(18-6-3-2-4-7-18)25(32-23)20-9-10-21-19(14-20)8-5-11-29-21/h2-15,17,31H,16H2,1H3,(H2,27,33)
InChIKeyNUNLDHTWNWCSQO-UHFFFAOYSA-N
XLogP4.58
TPSA102.50 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500433.52
LogP ≤ 54.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

3-methyl-6-phenyl-5-quinolin-6-ylpyrazin-2-amine
CID 137430865
3-amino-5-phenyl-N-[(1S)-1-pyridin-2-ylethyl]-6-quinolin-6-ylpyrazine-2-carboxamide
CID 154604613
3-amino-5-phenyl-N-(pyrimidin-5-ylmethyl)-6-quinolin-6-ylpyrazine-2-carboxamide
CID 154604481
3-amino-5-phenyl-N-(1-phenylethyl)-6-quinolin-6-ylpyrazine-2-carboxamide;3-amino-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxylic acid;1-phenylethanamine
CID 164995746
pyrazin-2-yl(quinolin-6-yl)methanol
CID 63969432
3-amino-5-(3-cyanophenyl)-N-[(1S)-1-pyridin-2-ylethyl]-6-quinolin-6-ylpyrazine-2-carboxamide
CID 164607280
2-propan-2-yl-4-quinolin-6-ylimidazole-1,5-diamine
CID 63970356
3-amino-N-[[5-(methanesulfonamido)-2-pyridinyl]methyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide
CID 155003048
3-[(4-aminocyclohexyl)methoxy]-6-phenyl-5-quinolin-6-ylpyrazin-2-amine
CID 154604645
3-amino-N-[(3Z)-3-(methylideneamino)hexa-3,5-dien-2-yl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide
CID 154656358
3-amino-N-[2-(3-methyl-2-pyridinyl)propan-2-yl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide
CID 154604777
3-amino-N-(7-methyl-5,6-dihydrocyclopenta[b]pyridin-7-yl)-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide
CID 154657981

Frequently Asked Questions

What is the IUPAC name of 6-phenyl-3-[(1-pyrazin-2-ylethylamino)methyl]-5-quinolin-6-ylpyrazin-2-amine?
The IUPAC name of 6-phenyl-3-[(1-pyrazin-2-ylethylamino)methyl]-5-quinolin-6-ylpyrazin-2-amine (CID 154657983) is 6-phenyl-3-[(1-pyrazin-2-ylethylamino)methyl]-5-quinolin-6-ylpyrazin-2-amine.
What is the SMILES notation for 6-phenyl-3-[(1-pyrazin-2-ylethylamino)methyl]-5-quinolin-6-ylpyrazin-2-amine?
The canonical SMILES for 6-phenyl-3-[(1-pyrazin-2-ylethylamino)methyl]-5-quinolin-6-ylpyrazin-2-amine is CC(NCc1nc(-c2ccc3ncccc3c2)c(-c2ccccc2)nc1N)c1cnccn1.
What is the InChIKey of 6-phenyl-3-[(1-pyrazin-2-ylethylamino)methyl]-5-quinolin-6-ylpyrazin-2-amine?
The InChIKey is NUNLDHTWNWCSQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H23N7/c1-17(22-15-28-12-13-30-22)31-16-23-26(27)33-24(18-6-3-2-4-7-18)25(32-23)20-9-10-21-19(14-20)8-5-11-29-21/h2-15,17,31H,16H2,1H3,(H2,27,33).
What are the key properties of 6-phenyl-3-[(1-pyrazin-2-ylethylamino)methyl]-5-quinolin-6-ylpyrazin-2-amine?
6-phenyl-3-[(1-pyrazin-2-ylethylamino)methyl]-5-quinolin-6-ylpyrazin-2-amine has a molecular weight of 433.52 g/mol, XLogP of 4.58, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-phenyl-3-[(1-pyrazin-2-ylethylamino)methyl]-5-quinolin-6-ylpyrazin-2-amine is sourced from PubChem (CID 154657983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).