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

C16H16N4 — CID 78989285

IUPACN-[2-(3-methylphenyl)ethyl]pyrido[2,3-b]pyrazin-6-amine
SMILESCc1cccc(CCNc2ccc3nccnc3n2)c1
InChIInChI=1S/C16H16N4/c1-12-3-2-4-13(11-12)7-8-18-15-6-5-14-16(20-15)19-10-9-17-14/h2-6,9-11H,7-8H2,1H3,(H,18,19,20)
InChIKeyOACUSGXEGDRIDU-UHFFFAOYSA-N
MW264.33 g/mol
LogP2.99
Rot. Bonds4

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

N-[2-(3-methylphenyl)ethyl]pyrido[2,3-b]pyrazin-6-amine (PubChem CID 78989285) has the molecular formula C16H16N4 and a molecular weight of 264.33 g/mol. Its IUPAC name is N-[2-(3-methylphenyl)ethyl]pyrido[2,3-b]pyrazin-6-amine.

Molecular Properties

Compound NameN-[2-(3-methylphenyl)ethyl]pyrido[2,3-b]pyrazin-6-amine
PubChem CID78989285
Molecular FormulaC16H16N4
Molecular Weight264.33 g/mol
Exact Mass264.14
IUPAC NameN-[2-(3-methylphenyl)ethyl]pyrido[2,3-b]pyrazin-6-amine
SMILESCc1cccc(CCNc2ccc3nccnc3n2)c1
InChIInChI=1S/C16H16N4/c1-12-3-2-4-13(11-12)7-8-18-15-6-5-14-16(20-15)19-10-9-17-14/h2-6,9-11H,7-8H2,1H3,(H,18,19,20)
InChIKeyOACUSGXEGDRIDU-UHFFFAOYSA-N
XLogP2.99
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 ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-N-[2-(3-methylphenyl)ethyl]pyridine-2,6-diamine
CID 80647053
N-[2-[(3-methoxyphenyl)methoxy]ethyl]pyrido[2,3-b]pyrazin-6-amine
CID 133390223
4-N-[2-(3-chlorophenyl)ethyl]-2-N-[(3-methylphenyl)methyl]pyrimidine-2,4-diamine
CID 112890184
N'-pyrido[2,3-b]pyrazin-6-yl-N-quinolin-2-ylethane-1,2-diamine
CID 133309761
6-methyl-4-N-[2-(3-methylphenyl)ethyl]pyrimidine-2,4-diamine
CID 78989212
6-N-methyl-2-N-[2-(3-methylphenyl)ethyl]pyrazine-2,6-diamine
CID 80826170
6-ethoxy-2-methyl-N-[2-(3-methylphenyl)ethyl]pyrimidin-4-amine
CID 66325892
N-[2-(3-methylphenyl)ethyl]pyridin-4-amine
CID 62315390
4,6-dimethyl-N-[2-(3-methylphenyl)ethyl]pyrimidin-2-amine
CID 62313023
N-(3-methylsulfanylpropyl)pyrido[2,3-b]pyrazin-6-amine
CID 78995491
N-(2-ethylsulfonylethyl)pyrido[2,3-b]pyrazin-6-amine
CID 103658809
N-(2-methylsulfonylethyl)pyrido[2,3-b]pyrazin-6-amine
CID 78955171

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-methylphenyl)ethyl]pyrido[2,3-b]pyrazin-6-amine?
The IUPAC name of N-[2-(3-methylphenyl)ethyl]pyrido[2,3-b]pyrazin-6-amine (CID 78989285) is N-[2-(3-methylphenyl)ethyl]pyrido[2,3-b]pyrazin-6-amine.
What is the SMILES notation for N-[2-(3-methylphenyl)ethyl]pyrido[2,3-b]pyrazin-6-amine?
The canonical SMILES for N-[2-(3-methylphenyl)ethyl]pyrido[2,3-b]pyrazin-6-amine is Cc1cccc(CCNc2ccc3nccnc3n2)c1.
What is the InChIKey of N-[2-(3-methylphenyl)ethyl]pyrido[2,3-b]pyrazin-6-amine?
The InChIKey is OACUSGXEGDRIDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4/c1-12-3-2-4-13(11-12)7-8-18-15-6-5-14-16(20-15)19-10-9-17-14/h2-6,9-11H,7-8H2,1H3,(H,18,19,20).
What are the key properties of N-[2-(3-methylphenyl)ethyl]pyrido[2,3-b]pyrazin-6-amine?
N-[2-(3-methylphenyl)ethyl]pyrido[2,3-b]pyrazin-6-amine has a molecular weight of 264.33 g/mol, XLogP of 2.99, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-methylphenyl)ethyl]pyrido[2,3-b]pyrazin-6-amine is sourced from PubChem (CID 78989285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).