N-[(4-methyl-1,2,4-triazol-3-yl)methyl]pyrido[2,3-b]pyrazin-6-amine

C11H11N7 — CID 78955166

IUPACN-[(4-methyl-1,2,4-triazol-3-yl)methyl]pyrido[2,3-b]pyrazin-6-amine
SMILESCn1cnnc1CNc1ccc2nccnc2n1
InChIInChI=1S/C11H11N7/c1-18-7-15-17-10(18)6-14-9-3-2-8-11(16-9)13-5-4-12-8/h2-5,7H,6H2,1H3,(H,13,14,16)
InChIKeyKJSXJLIMASCXKV-UHFFFAOYSA-N
MW241.26 g/mol
LogP0.77
Rot. Bonds3

About N-[(4-methyl-1,2,4-triazol-3-yl)methyl]pyrido[2,3-b]pyrazin-6-amine

N-[(4-methyl-1,2,4-triazol-3-yl)methyl]pyrido[2,3-b]pyrazin-6-amine (PubChem CID 78955166) has the molecular formula C11H11N7 and a molecular weight of 241.26 g/mol. Its IUPAC name is N-[(4-methyl-1,2,4-triazol-3-yl)methyl]pyrido[2,3-b]pyrazin-6-amine.

Molecular Properties

Compound NameN-[(4-methyl-1,2,4-triazol-3-yl)methyl]pyrido[2,3-b]pyrazin-6-amine
PubChem CID78955166
Molecular FormulaC11H11N7
Molecular Weight241.26 g/mol
Exact Mass241.11
IUPAC NameN-[(4-methyl-1,2,4-triazol-3-yl)methyl]pyrido[2,3-b]pyrazin-6-amine
SMILESCn1cnnc1CNc1ccc2nccnc2n1
InChIInChI=1S/C11H11N7/c1-18-7-15-17-10(18)6-14-9-3-2-8-11(16-9)13-5-4-12-8/h2-5,7H,6H2,1H3,(H,13,14,16)
InChIKeyKJSXJLIMASCXKV-UHFFFAOYSA-N
XLogP0.77
TPSA81.41 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.26
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-[(1-methylpyrazol-4-yl)methyl]pyrido[2,3-b]pyrazin-6-amine
CID 78988402
2-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]pyridine-2,4-diamine
CID 62117304
N-[(2-ethylphenyl)methyl]pyrido[2,3-b]pyrazin-6-amine
CID 79003296
4,6-dichloro-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]-1,3,5-triazin-2-amine
CID 62869757
N-[(4-bromophenyl)methyl]pyrido[2,3-b]pyrazin-6-amine
CID 78948042
1-methyl-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]imidazol-2-amine
CID 62133277
N-(2-methylsulfonylethyl)pyrido[2,3-b]pyrazin-6-amine
CID 78955171
N-(2-imidazol-1-ylethyl)pyrido[2,3-b]pyrazin-6-amine
CID 78955202
N-(2-fluoroethyl)pyrido[2,3-b]pyrazin-6-amine
CID 130478045
N-[(1-cyclopropylbenzimidazol-2-yl)methyl]pyrido[2,3-b]pyrazin-6-amine
CID 133466685
N-[(4-methyl-1,2,4-triazol-3-yl)methyl]-1,3-thiazol-2-amine
CID 60754232
N-[(2-chlorophenyl)methyl]pyrido[2,3-b]pyrazin-6-amine
CID 78981083

Frequently Asked Questions

What is the IUPAC name of N-[(4-methyl-1,2,4-triazol-3-yl)methyl]pyrido[2,3-b]pyrazin-6-amine?
The IUPAC name of N-[(4-methyl-1,2,4-triazol-3-yl)methyl]pyrido[2,3-b]pyrazin-6-amine (CID 78955166) is N-[(4-methyl-1,2,4-triazol-3-yl)methyl]pyrido[2,3-b]pyrazin-6-amine.
What is the SMILES notation for N-[(4-methyl-1,2,4-triazol-3-yl)methyl]pyrido[2,3-b]pyrazin-6-amine?
The canonical SMILES for N-[(4-methyl-1,2,4-triazol-3-yl)methyl]pyrido[2,3-b]pyrazin-6-amine is Cn1cnnc1CNc1ccc2nccnc2n1.
What is the InChIKey of N-[(4-methyl-1,2,4-triazol-3-yl)methyl]pyrido[2,3-b]pyrazin-6-amine?
The InChIKey is KJSXJLIMASCXKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N7/c1-18-7-15-17-10(18)6-14-9-3-2-8-11(16-9)13-5-4-12-8/h2-5,7H,6H2,1H3,(H,13,14,16).
What are the key properties of N-[(4-methyl-1,2,4-triazol-3-yl)methyl]pyrido[2,3-b]pyrazin-6-amine?
N-[(4-methyl-1,2,4-triazol-3-yl)methyl]pyrido[2,3-b]pyrazin-6-amine has a molecular weight of 241.26 g/mol, XLogP of 0.77, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methyl-1,2,4-triazol-3-yl)methyl]pyrido[2,3-b]pyrazin-6-amine is sourced from PubChem (CID 78955166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).