N-(2-phenylpropyl)pyrido[2,3-b]pyrazin-6-amine

C16H16N4 — CID 115599010

IUPACN-(2-phenylpropyl)pyrido[2,3-b]pyrazin-6-amine
SMILESCC(CNc1ccc2nccnc2n1)c1ccccc1
InChIInChI=1S/C16H16N4/c1-12(13-5-3-2-4-6-13)11-19-15-8-7-14-16(20-15)18-10-9-17-14/h2-10,12H,11H2,1H3,(H,18,19,20)
InChIKeyGKBGCEGOTYIMJK-UHFFFAOYSA-N
MW264.33 g/mol
LogP3.24
Rot. Bonds4

About N-(2-phenylpropyl)pyrido[2,3-b]pyrazin-6-amine

N-(2-phenylpropyl)pyrido[2,3-b]pyrazin-6-amine (PubChem CID 115599010) has the molecular formula C16H16N4 and a molecular weight of 264.33 g/mol. Its IUPAC name is N-(2-phenylpropyl)pyrido[2,3-b]pyrazin-6-amine.

Molecular Properties

Compound NameN-(2-phenylpropyl)pyrido[2,3-b]pyrazin-6-amine
PubChem CID115599010
Molecular FormulaC16H16N4
Molecular Weight264.33 g/mol
Exact Mass264.14
IUPAC NameN-(2-phenylpropyl)pyrido[2,3-b]pyrazin-6-amine
SMILESCC(CNc1ccc2nccnc2n1)c1ccccc1
InChIInChI=1S/C16H16N4/c1-12(13-5-3-2-4-6-13)11-19-15-8-7-14-16(20-15)18-10-9-17-14/h2-10,12H,11H2,1H3,(H,18,19,20)
InChIKeyGKBGCEGOTYIMJK-UHFFFAOYSA-N
XLogP3.24
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-phenylpropyl)pyrido[2,3-b]pyrazin-6-amine?
The IUPAC name of N-(2-phenylpropyl)pyrido[2,3-b]pyrazin-6-amine (CID 115599010) is N-(2-phenylpropyl)pyrido[2,3-b]pyrazin-6-amine.
What is the SMILES notation for N-(2-phenylpropyl)pyrido[2,3-b]pyrazin-6-amine?
The canonical SMILES for N-(2-phenylpropyl)pyrido[2,3-b]pyrazin-6-amine is CC(CNc1ccc2nccnc2n1)c1ccccc1.
What is the InChIKey of N-(2-phenylpropyl)pyrido[2,3-b]pyrazin-6-amine?
The InChIKey is GKBGCEGOTYIMJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4/c1-12(13-5-3-2-4-6-13)11-19-15-8-7-14-16(20-15)18-10-9-17-14/h2-10,12H,11H2,1H3,(H,18,19,20).
What are the key properties of N-(2-phenylpropyl)pyrido[2,3-b]pyrazin-6-amine?
N-(2-phenylpropyl)pyrido[2,3-b]pyrazin-6-amine has a molecular weight of 264.33 g/mol, XLogP of 3.24, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenylpropyl)pyrido[2,3-b]pyrazin-6-amine is sourced from PubChem (CID 115599010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).