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

C18H18N4 — CID 97328892

IUPACN-[(1R,2R)-2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl]pyrido[2,3-b]pyrazin-6-amine
SMILESC[C@@H]1CCc2ccccc2[C@@H]1Nc1ccc2nccnc2n1
InChIInChI=1S/C18H18N4/c1-12-6-7-13-4-2-3-5-14(13)17(12)21-16-9-8-15-18(22-16)20-11-10-19-15/h2-5,8-12,17H,6-7H2,1H3,(H,20,21,22)/t12-,17-/m1/s1
InChIKeyFRAQIHAALFKYJV-SJKOYZFVSA-N
MW290.37 g/mol
LogP3.76
Rot. Bonds2

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

N-[(1R,2R)-2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl]pyrido[2,3-b]pyrazin-6-amine (PubChem CID 97328892) has the molecular formula C18H18N4 and a molecular weight of 290.37 g/mol. Its IUPAC name is N-[(1R,2R)-2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl]pyrido[2,3-b]pyrazin-6-amine.

Molecular Properties

Compound NameN-[(1R,2R)-2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl]pyrido[2,3-b]pyrazin-6-amine
PubChem CID97328892
Molecular FormulaC18H18N4
Molecular Weight290.37 g/mol
Exact Mass290.15
IUPAC NameN-[(1R,2R)-2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl]pyrido[2,3-b]pyrazin-6-amine
SMILESC[C@@H]1CCc2ccccc2[C@@H]1Nc1ccc2nccnc2n1
InChIInChI=1S/C18H18N4/c1-12-6-7-13-4-2-3-5-14(13)17(12)21-16-9-8-15-18(22-16)20-11-10-19-15/h2-5,8-12,17H,6-7H2,1H3,(H,20,21,22)/t12-,17-/m1/s1
InChIKeyFRAQIHAALFKYJV-SJKOYZFVSA-N
XLogP3.76
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(1R,2R)-2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl]pyrido[2,3-b]pyrazin-6-amine?
The IUPAC name of N-[(1R,2R)-2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl]pyrido[2,3-b]pyrazin-6-amine (CID 97328892) is N-[(1R,2R)-2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl]pyrido[2,3-b]pyrazin-6-amine.
What is the SMILES notation for N-[(1R,2R)-2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl]pyrido[2,3-b]pyrazin-6-amine?
The canonical SMILES for N-[(1R,2R)-2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl]pyrido[2,3-b]pyrazin-6-amine is C[C@@H]1CCc2ccccc2[C@@H]1Nc1ccc2nccnc2n1.
What is the InChIKey of N-[(1R,2R)-2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl]pyrido[2,3-b]pyrazin-6-amine?
The InChIKey is FRAQIHAALFKYJV-SJKOYZFVSA-N. The full InChI is InChI=1S/C18H18N4/c1-12-6-7-13-4-2-3-5-14(13)17(12)21-16-9-8-15-18(22-16)20-11-10-19-15/h2-5,8-12,17H,6-7H2,1H3,(H,20,21,22)/t12-,17-/m1/s1.
What are the key properties of N-[(1R,2R)-2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl]pyrido[2,3-b]pyrazin-6-amine?
N-[(1R,2R)-2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl]pyrido[2,3-b]pyrazin-6-amine has a molecular weight of 290.37 g/mol, XLogP of 3.76, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R,2R)-2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl]pyrido[2,3-b]pyrazin-6-amine is sourced from PubChem (CID 97328892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).