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

C18H16N6 — CID 133411514

IUPACN-[[3-(1-methylpyrazol-4-yl)phenyl]methyl]pyrido[2,3-b]pyrazin-6-amine
SMILESCn1cc(-c2cccc(CNc3ccc4nccnc4n3)c2)cn1
InChIInChI=1S/C18H16N6/c1-24-12-15(11-22-24)14-4-2-3-13(9-14)10-21-17-6-5-16-18(23-17)20-8-7-19-16/h2-9,11-12H,10H2,1H3,(H,20,21,23)
InChIKeyZJCLDVMGHXJWKU-UHFFFAOYSA-N
MW316.37 g/mol
LogP3.04
Rot. Bonds4

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

N-[[3-(1-methylpyrazol-4-yl)phenyl]methyl]pyrido[2,3-b]pyrazin-6-amine (PubChem CID 133411514) has the molecular formula C18H16N6 and a molecular weight of 316.37 g/mol. Its IUPAC name is N-[[3-(1-methylpyrazol-4-yl)phenyl]methyl]pyrido[2,3-b]pyrazin-6-amine.

Molecular Properties

Compound NameN-[[3-(1-methylpyrazol-4-yl)phenyl]methyl]pyrido[2,3-b]pyrazin-6-amine
PubChem CID133411514
Molecular FormulaC18H16N6
Molecular Weight316.37 g/mol
Exact Mass316.14
IUPAC NameN-[[3-(1-methylpyrazol-4-yl)phenyl]methyl]pyrido[2,3-b]pyrazin-6-amine
SMILESCn1cc(-c2cccc(CNc3ccc4nccnc4n3)c2)cn1
InChIInChI=1S/C18H16N6/c1-24-12-15(11-22-24)14-4-2-3-13(9-14)10-21-17-6-5-16-18(23-17)20-8-7-19-16/h2-9,11-12H,10H2,1H3,(H,20,21,23)
InChIKeyZJCLDVMGHXJWKU-UHFFFAOYSA-N
XLogP3.04
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.37
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(1-methylpyrazol-4-yl)methyl]pyrido[2,3-b]pyrazin-6-amine
CID 78988402
2-cyclopropyl-N-[[3-(1-methylpyrazol-4-yl)phenyl]methyl]pyrimidin-4-amine
CID 133411504
6-chloro-N-[[3-(1-methylpyrazol-4-yl)phenyl]methyl]pyrazin-2-amine
CID 133411679
5-methyl-N-[[3-(1-methylpyrazol-4-yl)phenyl]methyl]pyrimidin-2-amine
CID 133411690
ethyl 6-[[3-(1-methylpyrazol-4-yl)phenyl]methylamino]pyridine-3-carboxylate
CID 133411663
N-(1,3-benzodioxol-5-ylmethyl)pyrido[2,3-b]pyrazin-6-amine
CID 78980843
N-[(4-fluorophenyl)methyl]-7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-amine
CID 122184265
[3-(1-methylpyrazol-4-yl)phenyl]methanamine
CID 61033657
6-methyl-N-[[3-(1-methylpyrazol-4-yl)phenyl]methyl]-2-(3-nitrophenyl)pyrimidin-4-amine
CID 133411695
2,6-dimethyl-4-[[3-(1-methylpyrazol-4-yl)phenyl]methylamino]pyridine-3-carbonitrile
CID 133411675
N-methyl-2-[3-(1-methylpyrazol-4-yl)phenyl]ethanamine
CID 24963506
N-[(4-bromophenyl)methyl]pyrido[2,3-b]pyrazin-6-amine
CID 78948042

Frequently Asked Questions

What is the IUPAC name of N-[[3-(1-methylpyrazol-4-yl)phenyl]methyl]pyrido[2,3-b]pyrazin-6-amine?
The IUPAC name of N-[[3-(1-methylpyrazol-4-yl)phenyl]methyl]pyrido[2,3-b]pyrazin-6-amine (CID 133411514) is N-[[3-(1-methylpyrazol-4-yl)phenyl]methyl]pyrido[2,3-b]pyrazin-6-amine.
What is the SMILES notation for N-[[3-(1-methylpyrazol-4-yl)phenyl]methyl]pyrido[2,3-b]pyrazin-6-amine?
The canonical SMILES for N-[[3-(1-methylpyrazol-4-yl)phenyl]methyl]pyrido[2,3-b]pyrazin-6-amine is Cn1cc(-c2cccc(CNc3ccc4nccnc4n3)c2)cn1.
What is the InChIKey of N-[[3-(1-methylpyrazol-4-yl)phenyl]methyl]pyrido[2,3-b]pyrazin-6-amine?
The InChIKey is ZJCLDVMGHXJWKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N6/c1-24-12-15(11-22-24)14-4-2-3-13(9-14)10-21-17-6-5-16-18(23-17)20-8-7-19-16/h2-9,11-12H,10H2,1H3,(H,20,21,23).
What are the key properties of N-[[3-(1-methylpyrazol-4-yl)phenyl]methyl]pyrido[2,3-b]pyrazin-6-amine?
N-[[3-(1-methylpyrazol-4-yl)phenyl]methyl]pyrido[2,3-b]pyrazin-6-amine has a molecular weight of 316.37 g/mol, XLogP of 3.04, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(1-methylpyrazol-4-yl)phenyl]methyl]pyrido[2,3-b]pyrazin-6-amine is sourced from PubChem (CID 133411514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).