3-methyl-2-naphthalen-1-yl-5-propan-2-ylpyrazine

C18H18N2 — CID 58219431

IUPAC3-methyl-2-naphthalen-1-yl-5-propan-2-ylpyrazine
SMILESCc1nc(C(C)C)cnc1-c1cccc2ccccc12
InChIInChI=1S/C18H18N2/c1-12(2)17-11-19-18(13(3)20-17)16-10-6-8-14-7-4-5-9-15(14)16/h4-12H,1-3H3
InChIKeyDJWWLNQJQRSRDG-UHFFFAOYSA-N
MW262.36 g/mol
LogP4.73
Rot. Bonds2

About 3-methyl-2-naphthalen-1-yl-5-propan-2-ylpyrazine

3-methyl-2-naphthalen-1-yl-5-propan-2-ylpyrazine (PubChem CID 58219431) has the molecular formula C18H18N2 and a molecular weight of 262.36 g/mol. Its IUPAC name is 3-methyl-2-naphthalen-1-yl-5-propan-2-ylpyrazine.

Molecular Properties

Compound Name3-methyl-2-naphthalen-1-yl-5-propan-2-ylpyrazine
PubChem CID58219431
Molecular FormulaC18H18N2
Molecular Weight262.36 g/mol
Exact Mass262.15
IUPAC Name3-methyl-2-naphthalen-1-yl-5-propan-2-ylpyrazine
SMILESCc1nc(C(C)C)cnc1-c1cccc2ccccc12
InChIInChI=1S/C18H18N2/c1-12(2)17-11-19-18(13(3)20-17)16-10-6-8-14-7-4-5-9-15(14)16/h4-12H,1-3H3
InChIKeyDJWWLNQJQRSRDG-UHFFFAOYSA-N
XLogP4.73
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 54.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,6-dimethyl-3-(2-methylphenyl)-5-naphthalen-1-ylpyrazine
CID 145390440
2-naphthalen-1-yl-5-propan-2-ylpyrimidine
CID 176640404
4-naphthalen-1-yl-5-propan-2-yl-1H-imidazol-2-amine
CID 11311287
5-methyl-2-naphthalen-1-ylpyridine
CID 59742245
2,3,5-trimethyl-6-(4-naphthalen-1-ylphenyl)pyrazine
CID 58461112
2-naphthalen-1-yl-6-propan-2-ylpyrimidin-4-amine
CID 62203179
6-methyl-2-naphthalen-1-yl-5-propan-2-ylpyrimidin-4-amine
CID 62916015
2-methyl-5-naphthalen-1-ylpyrazine
CID 118148882
2,5-dimethyl-4-naphthalen-1-yl-1H-pyrimidin-6-one
CID 136691790
3-ethyl-1-naphthalen-1-ylisoquinoline
CID 140508160
4-methyl-2-naphthalen-1-ylpyridine
CID 13433020
CID 175282704
CID 175282704

Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-naphthalen-1-yl-5-propan-2-ylpyrazine?
The IUPAC name of 3-methyl-2-naphthalen-1-yl-5-propan-2-ylpyrazine (CID 58219431) is 3-methyl-2-naphthalen-1-yl-5-propan-2-ylpyrazine.
What is the SMILES notation for 3-methyl-2-naphthalen-1-yl-5-propan-2-ylpyrazine?
The canonical SMILES for 3-methyl-2-naphthalen-1-yl-5-propan-2-ylpyrazine is Cc1nc(C(C)C)cnc1-c1cccc2ccccc12.
What is the InChIKey of 3-methyl-2-naphthalen-1-yl-5-propan-2-ylpyrazine?
The InChIKey is DJWWLNQJQRSRDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2/c1-12(2)17-11-19-18(13(3)20-17)16-10-6-8-14-7-4-5-9-15(14)16/h4-12H,1-3H3.
What are the key properties of 3-methyl-2-naphthalen-1-yl-5-propan-2-ylpyrazine?
3-methyl-2-naphthalen-1-yl-5-propan-2-ylpyrazine has a molecular weight of 262.36 g/mol, XLogP of 4.73, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-naphthalen-1-yl-5-propan-2-ylpyrazine is sourced from PubChem (CID 58219431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).