6-N-methyl-2-N-(2-phenylethyl)pyrazine-2,6-diamine

C13H16N4 — CID 80778395

IUPAC6-N-methyl-2-N-(2-phenylethyl)pyrazine-2,6-diamine
SMILESCNc1cncc(NCCc2ccccc2)n1
InChIInChI=1S/C13H16N4/c1-14-12-9-15-10-13(17-12)16-8-7-11-5-3-2-4-6-11/h2-6,9-10H,7-8H2,1H3,(H2,14,16,17)
InChIKeyUPLVPNWWXDNESC-UHFFFAOYSA-N
MW228.30 g/mol
LogP2.17
Rot. Bonds5

About 6-N-methyl-2-N-(2-phenylethyl)pyrazine-2,6-diamine

6-N-methyl-2-N-(2-phenylethyl)pyrazine-2,6-diamine (PubChem CID 80778395) has the molecular formula C13H16N4 and a molecular weight of 228.30 g/mol. Its IUPAC name is 6-N-methyl-2-N-(2-phenylethyl)pyrazine-2,6-diamine.

Molecular Properties

Compound Name6-N-methyl-2-N-(2-phenylethyl)pyrazine-2,6-diamine
PubChem CID80778395
Molecular FormulaC13H16N4
Molecular Weight228.30 g/mol
Exact Mass228.14
IUPAC Name6-N-methyl-2-N-(2-phenylethyl)pyrazine-2,6-diamine
SMILESCNc1cncc(NCCc2ccccc2)n1
InChIInChI=1S/C13H16N4/c1-14-12-9-15-10-13(17-12)16-8-7-11-5-3-2-4-6-11/h2-6,9-10H,7-8H2,1H3,(H2,14,16,17)
InChIKeyUPLVPNWWXDNESC-UHFFFAOYSA-N
XLogP2.17
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-N-methyl-2-N-[2-(3-methylphenyl)ethyl]pyrazine-2,6-diamine
CID 80826170
6-N-methyl-4-N-(2-phenylethyl)pyrimidine-2,4,6-triamine
CID 80777642
6-N-methyl-2-N-[3-(N-methylanilino)propyl]pyrazine-2,6-diamine
CID 80784811
6-N-ethyl-2-N-(2-pyridin-3-ylethyl)pyrazine-2,6-diamine
CID 78990149
6-chloro-N-(3-phenylpropyl)pyrazin-2-amine
CID 11608477
2-N-methyl-4-N-(2-phenylethyl)pyrimidine-2,4-diamine
CID 80777641
6-N-methyl-2-N-[2-(1-methylpyrazol-3-yl)ethyl]pyrazine-2,6-diamine
CID 106106850
3-N,5-N-bis(2-phenylethyl)-1,2,4-triazine-3,5-diamine
CID 112952784
N-(2-phenylethyl)quinolin-2-amine
CID 29300407
4-[2-[[6-(methylamino)-2-pyridinyl]amino]ethyl]phenol
CID 80798348
6-N-methyl-4-N-(3-phenylpropyl)pyrimidine-2,4,6-triamine
CID 80791770
6-N-[2-(3-methoxyphenyl)ethyl]-2-N-methylpyridine-2,6-diamine
CID 107855522

Frequently Asked Questions

What is the IUPAC name of 6-N-methyl-2-N-(2-phenylethyl)pyrazine-2,6-diamine?
The IUPAC name of 6-N-methyl-2-N-(2-phenylethyl)pyrazine-2,6-diamine (CID 80778395) is 6-N-methyl-2-N-(2-phenylethyl)pyrazine-2,6-diamine.
What is the SMILES notation for 6-N-methyl-2-N-(2-phenylethyl)pyrazine-2,6-diamine?
The canonical SMILES for 6-N-methyl-2-N-(2-phenylethyl)pyrazine-2,6-diamine is CNc1cncc(NCCc2ccccc2)n1.
What is the InChIKey of 6-N-methyl-2-N-(2-phenylethyl)pyrazine-2,6-diamine?
The InChIKey is UPLVPNWWXDNESC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4/c1-14-12-9-15-10-13(17-12)16-8-7-11-5-3-2-4-6-11/h2-6,9-10H,7-8H2,1H3,(H2,14,16,17).
What are the key properties of 6-N-methyl-2-N-(2-phenylethyl)pyrazine-2,6-diamine?
6-N-methyl-2-N-(2-phenylethyl)pyrazine-2,6-diamine has a molecular weight of 228.30 g/mol, XLogP of 2.17, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-methyl-2-N-(2-phenylethyl)pyrazine-2,6-diamine is sourced from PubChem (CID 80778395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).