N-(2-imidazol-1-ylethyl)pyrido[2,3-b]pyrazin-6-amine

C12H12N6 — CID 78955202

IUPACN-(2-imidazol-1-ylethyl)pyrido[2,3-b]pyrazin-6-amine
SMILESc1cn(CCNc2ccc3nccnc3n2)cn1
InChIInChI=1S/C12H12N6/c1-2-11(15-6-8-18-7-5-13-9-18)17-12-10(1)14-3-4-16-12/h1-5,7,9H,6,8H2,(H,15,16,17)
InChIKeyMSBUPQUDSUQADE-UHFFFAOYSA-N
MW240.27 g/mol
LogP1.33
Rot. Bonds4

About N-(2-imidazol-1-ylethyl)pyrido[2,3-b]pyrazin-6-amine

N-(2-imidazol-1-ylethyl)pyrido[2,3-b]pyrazin-6-amine (PubChem CID 78955202) has the molecular formula C12H12N6 and a molecular weight of 240.27 g/mol. Its IUPAC name is N-(2-imidazol-1-ylethyl)pyrido[2,3-b]pyrazin-6-amine.

Molecular Properties

Compound NameN-(2-imidazol-1-ylethyl)pyrido[2,3-b]pyrazin-6-amine
PubChem CID78955202
Molecular FormulaC12H12N6
Molecular Weight240.27 g/mol
Exact Mass240.11
IUPAC NameN-(2-imidazol-1-ylethyl)pyrido[2,3-b]pyrazin-6-amine
SMILESc1cn(CCNc2ccc3nccnc3n2)cn1
InChIInChI=1S/C12H12N6/c1-2-11(15-6-8-18-7-5-13-9-18)17-12-10(1)14-3-4-16-12/h1-5,7,9H,6,8H2,(H,15,16,17)
InChIKeyMSBUPQUDSUQADE-UHFFFAOYSA-N
XLogP1.33
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.27
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(2-imidazol-1-ylethylamino)quinoline-6-carbonitrile
CID 75505975
N-(2-imidazol-1-ylethyl)pyrimidin-4-amine
CID 61325111
4-N-(2-imidazol-1-ylethyl)-2-N-propylpyrimidine-2,4-diamine
CID 80809698
N-(2-imidazol-1-ylethyl)-6-nitroquinolin-2-amine
CID 61324302
N-(2-imidazol-1-ylethyl)-5-(trifluoromethyl)pyridin-2-amine
CID 60632035
N-(2-imidazol-1-ylethyl)-6-methoxypyridin-2-amine
CID 63590047
N-(2-cyclopropylethyl)pyrido[2,3-b]pyrazin-6-amine
CID 79033935
N-(3-imidazol-1-ylpropyl)-5-methyl-1,6-naphthyridin-2-amine
CID 154338498
N-(2-methylsulfonylethyl)pyrido[2,3-b]pyrazin-6-amine
CID 78955171
N-(2-ethylsulfonylethyl)pyrido[2,3-b]pyrazin-6-amine
CID 103658809
N-(3-methylsulfanylpropyl)pyrido[2,3-b]pyrazin-6-amine
CID 78995491
N-(3-methyl-2-propan-2-ylbutyl)pyrido[2,3-b]pyrazin-6-amine
CID 102913962

Frequently Asked Questions

What is the IUPAC name of N-(2-imidazol-1-ylethyl)pyrido[2,3-b]pyrazin-6-amine?
The IUPAC name of N-(2-imidazol-1-ylethyl)pyrido[2,3-b]pyrazin-6-amine (CID 78955202) is N-(2-imidazol-1-ylethyl)pyrido[2,3-b]pyrazin-6-amine.
What is the SMILES notation for N-(2-imidazol-1-ylethyl)pyrido[2,3-b]pyrazin-6-amine?
The canonical SMILES for N-(2-imidazol-1-ylethyl)pyrido[2,3-b]pyrazin-6-amine is c1cn(CCNc2ccc3nccnc3n2)cn1.
What is the InChIKey of N-(2-imidazol-1-ylethyl)pyrido[2,3-b]pyrazin-6-amine?
The InChIKey is MSBUPQUDSUQADE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N6/c1-2-11(15-6-8-18-7-5-13-9-18)17-12-10(1)14-3-4-16-12/h1-5,7,9H,6,8H2,(H,15,16,17).
What are the key properties of N-(2-imidazol-1-ylethyl)pyrido[2,3-b]pyrazin-6-amine?
N-(2-imidazol-1-ylethyl)pyrido[2,3-b]pyrazin-6-amine has a molecular weight of 240.27 g/mol, XLogP of 1.33, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-imidazol-1-ylethyl)pyrido[2,3-b]pyrazin-6-amine is sourced from PubChem (CID 78955202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).