1-(3-methoxypyrazin-2-yl)-N-methyl-1-naphthalen-2-ylmethanamine

C17H17N3O — CID 104515510

IUPAC1-(3-methoxypyrazin-2-yl)-N-methyl-1-naphthalen-2-ylmethanamine
SMILESCNC(c1ccc2ccccc2c1)c1nccnc1OC
InChIInChI=1S/C17H17N3O/c1-18-15(16-17(21-2)20-10-9-19-16)14-8-7-12-5-3-4-6-13(12)11-14/h3-11,15,18H,1-2H3
InChIKeyUPBVMRVQLANWLK-UHFFFAOYSA-N
MW279.34 g/mol
LogP2.95
Rot. Bonds4

About 1-(3-methoxypyrazin-2-yl)-N-methyl-1-naphthalen-2-ylmethanamine

1-(3-methoxypyrazin-2-yl)-N-methyl-1-naphthalen-2-ylmethanamine (PubChem CID 104515510) has the molecular formula C17H17N3O and a molecular weight of 279.34 g/mol. Its IUPAC name is 1-(3-methoxypyrazin-2-yl)-N-methyl-1-naphthalen-2-ylmethanamine.

Molecular Properties

Compound Name1-(3-methoxypyrazin-2-yl)-N-methyl-1-naphthalen-2-ylmethanamine
PubChem CID104515510
Molecular FormulaC17H17N3O
Molecular Weight279.34 g/mol
Exact Mass279.14
IUPAC Name1-(3-methoxypyrazin-2-yl)-N-methyl-1-naphthalen-2-ylmethanamine
SMILESCNC(c1ccc2ccccc2c1)c1nccnc1OC
InChIInChI=1S/C17H17N3O/c1-18-15(16-17(21-2)20-10-9-19-16)14-8-7-12-5-3-4-6-13(12)11-14/h3-11,15,18H,1-2H3
InChIKeyUPBVMRVQLANWLK-UHFFFAOYSA-N
XLogP2.95
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3-methoxyphenyl)-1-(3-methoxypyrazin-2-yl)-N-methylmethanamine
CID 104515256
1-(3,4-dimethylphenyl)-1-(3-methoxypyrazin-2-yl)-N-methylmethanamine
CID 105031923
1-(3-methoxypyrazin-2-yl)-N-methyl-1-quinolin-2-ylmethanamine
CID 104515575
1-isoquinolin-1-yl-1-(3-methoxypyrazin-2-yl)-N-methylmethanamine
CID 104515594
1-(4-ethoxyphenyl)-1-(3-methoxypyrazin-2-yl)-N-methylmethanamine
CID 105032032
3-[(3-methoxypyrazin-2-yl)-(methylamino)methyl]-N,N-dimethylaniline
CID 105178666
1-(2,3-dihydro-1-benzofuran-5-yl)-1-(3-methoxypyrazin-2-yl)-N-methylmethanamine
CID 105031866
1-(2,6-dichlorophenyl)-1-(3-methoxypyrazin-2-yl)-N-methylmethanamine
CID 105032038
1-(3-bromo-2-pyridinyl)-1-(3-methoxypyrazin-2-yl)-N-methylmethanamine
CID 104516094
1-(2,4-dimethoxyphenyl)-1-(3-methoxypyrazin-2-yl)-N-methylmethanamine
CID 105031778
1-(3-chloro-5-methylphenyl)-1-(3-methoxypyrazin-2-yl)-N-methylmethanamine
CID 105032260
N-methyl-1-naphthalen-2-yl-1-(1H-1,2,4-triazol-5-yl)methanamine
CID 65362557

Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxypyrazin-2-yl)-N-methyl-1-naphthalen-2-ylmethanamine?
The IUPAC name of 1-(3-methoxypyrazin-2-yl)-N-methyl-1-naphthalen-2-ylmethanamine (CID 104515510) is 1-(3-methoxypyrazin-2-yl)-N-methyl-1-naphthalen-2-ylmethanamine.
What is the SMILES notation for 1-(3-methoxypyrazin-2-yl)-N-methyl-1-naphthalen-2-ylmethanamine?
The canonical SMILES for 1-(3-methoxypyrazin-2-yl)-N-methyl-1-naphthalen-2-ylmethanamine is CNC(c1ccc2ccccc2c1)c1nccnc1OC.
What is the InChIKey of 1-(3-methoxypyrazin-2-yl)-N-methyl-1-naphthalen-2-ylmethanamine?
The InChIKey is UPBVMRVQLANWLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O/c1-18-15(16-17(21-2)20-10-9-19-16)14-8-7-12-5-3-4-6-13(12)11-14/h3-11,15,18H,1-2H3.
What are the key properties of 1-(3-methoxypyrazin-2-yl)-N-methyl-1-naphthalen-2-ylmethanamine?
1-(3-methoxypyrazin-2-yl)-N-methyl-1-naphthalen-2-ylmethanamine has a molecular weight of 279.34 g/mol, XLogP of 2.95, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxypyrazin-2-yl)-N-methyl-1-naphthalen-2-ylmethanamine is sourced from PubChem (CID 104515510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).