8-butyl-N-ethyl-6-methyl-4-(2,4,6-trimethylphenyl)-2,3-dihydropyrido[2,3-b]pyrazin-1-amine

C23H34N4 — CID 70094257

IUPAC8-butyl-N-ethyl-6-methyl-4-(2,4,6-trimethylphenyl)-2,3-dihydropyrido[2,3-b]pyrazin-1-amine
SMILESCCCCc1cc(C)nc2c1N(NCC)CCN2c1c(C)cc(C)cc1C
InChIInChI=1S/C23H34N4/c1-7-9-10-20-15-19(6)25-23-22(20)27(24-8-2)12-11-26(23)21-17(4)13-16(3)14-18(21)5/h13-15,24H,7-12H2,1-6H3
InChIKeyZDGWNHHZVORCDZ-UHFFFAOYSA-N
MW366.55 g/mol
LogP5.14
Rot. Bonds6

About 8-butyl-N-ethyl-6-methyl-4-(2,4,6-trimethylphenyl)-2,3-dihydropyrido[2,3-b]pyrazin-1-amine

8-butyl-N-ethyl-6-methyl-4-(2,4,6-trimethylphenyl)-2,3-dihydropyrido[2,3-b]pyrazin-1-amine (PubChem CID 70094257) has the molecular formula C23H34N4 and a molecular weight of 366.55 g/mol. Its IUPAC name is 8-butyl-N-ethyl-6-methyl-4-(2,4,6-trimethylphenyl)-2,3-dihydropyrido[2,3-b]pyrazin-1-amine.

Molecular Properties

Compound Name8-butyl-N-ethyl-6-methyl-4-(2,4,6-trimethylphenyl)-2,3-dihydropyrido[2,3-b]pyrazin-1-amine
PubChem CID70094257
Molecular FormulaC23H34N4
Molecular Weight366.55 g/mol
Exact Mass366.28
IUPAC Name8-butyl-N-ethyl-6-methyl-4-(2,4,6-trimethylphenyl)-2,3-dihydropyrido[2,3-b]pyrazin-1-amine
SMILESCCCCc1cc(C)nc2c1N(NCC)CCN2c1c(C)cc(C)cc1C
InChIInChI=1S/C23H34N4/c1-7-9-10-20-15-19(6)25-23-22(20)27(24-8-2)12-11-26(23)21-17(4)13-16(3)14-18(21)5/h13-15,24H,7-12H2,1-6H3
InChIKeyZDGWNHHZVORCDZ-UHFFFAOYSA-N
XLogP5.14
TPSA31.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.55
LogP ≤ 55.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 8-butyl-N-ethyl-6-methyl-4-(2,4,6-trimethylphenyl)-2,3-dihydropyrido[2,3-b]pyrazin-1-amine?
The IUPAC name of 8-butyl-N-ethyl-6-methyl-4-(2,4,6-trimethylphenyl)-2,3-dihydropyrido[2,3-b]pyrazin-1-amine (CID 70094257) is 8-butyl-N-ethyl-6-methyl-4-(2,4,6-trimethylphenyl)-2,3-dihydropyrido[2,3-b]pyrazin-1-amine.
What is the SMILES notation for 8-butyl-N-ethyl-6-methyl-4-(2,4,6-trimethylphenyl)-2,3-dihydropyrido[2,3-b]pyrazin-1-amine?
The canonical SMILES for 8-butyl-N-ethyl-6-methyl-4-(2,4,6-trimethylphenyl)-2,3-dihydropyrido[2,3-b]pyrazin-1-amine is CCCCc1cc(C)nc2c1N(NCC)CCN2c1c(C)cc(C)cc1C.
What is the InChIKey of 8-butyl-N-ethyl-6-methyl-4-(2,4,6-trimethylphenyl)-2,3-dihydropyrido[2,3-b]pyrazin-1-amine?
The InChIKey is ZDGWNHHZVORCDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H34N4/c1-7-9-10-20-15-19(6)25-23-22(20)27(24-8-2)12-11-26(23)21-17(4)13-16(3)14-18(21)5/h13-15,24H,7-12H2,1-6H3.
What are the key properties of 8-butyl-N-ethyl-6-methyl-4-(2,4,6-trimethylphenyl)-2,3-dihydropyrido[2,3-b]pyrazin-1-amine?
8-butyl-N-ethyl-6-methyl-4-(2,4,6-trimethylphenyl)-2,3-dihydropyrido[2,3-b]pyrazin-1-amine has a molecular weight of 366.55 g/mol, XLogP of 5.14, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-butyl-N-ethyl-6-methyl-4-(2,4,6-trimethylphenyl)-2,3-dihydropyrido[2,3-b]pyrazin-1-amine is sourced from PubChem (CID 70094257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).