3,6-diethyl-N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)pyrazin-2-amine

C18H23N3O — CID 22147440

IUPAC3,6-diethyl-N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)pyrazin-2-amine
SMILESCCc1cnc(CC)c(NC2CCc3ccc(OC)cc32)n1
InChIInChI=1S/C18H23N3O/c1-4-13-11-19-16(5-2)18(20-13)21-17-9-7-12-6-8-14(22-3)10-15(12)17/h6,8,10-11,17H,4-5,7,9H2,1-3H3,(H,20,21)
InChIKeyYSGKTEIKRRNWQP-UHFFFAOYSA-N
MW297.40 g/mol
LogP3.71
Rot. Bonds5

About 3,6-diethyl-N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)pyrazin-2-amine

3,6-diethyl-N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)pyrazin-2-amine (PubChem CID 22147440) has the molecular formula C18H23N3O and a molecular weight of 297.40 g/mol. Its IUPAC name is 3,6-diethyl-N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)pyrazin-2-amine.

Molecular Properties

Compound Name3,6-diethyl-N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)pyrazin-2-amine
PubChem CID22147440
Molecular FormulaC18H23N3O
Molecular Weight297.40 g/mol
Exact Mass297.18
IUPAC Name3,6-diethyl-N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)pyrazin-2-amine
SMILESCCc1cnc(CC)c(NC2CCc3ccc(OC)cc32)n1
InChIInChI=1S/C18H23N3O/c1-4-13-11-19-16(5-2)18(20-13)21-17-9-7-12-6-8-14(22-3)10-15(12)17/h6,8,10-11,17H,4-5,7,9H2,1-3H3,(H,20,21)
InChIKeyYSGKTEIKRRNWQP-UHFFFAOYSA-N
XLogP3.71
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(2,4-dichlorophenyl)-3,6-diethyl-N-(7-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)pyrazin-2-amine
CID 10127588
2-methoxy-N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)pyridin-3-amine
CID 79366034
6-methoxy-N-(4-propylphenyl)-2,3-dihydro-1H-inden-1-amine
CID 79369357
6-methoxy-N-[(2-methyl-1,3-thiazol-5-yl)methyl]-2,3-dihydro-1H-inden-1-amine
CID 79366862
6-methoxy-N-(4-methylsulfanylphenyl)-2,3-dihydro-1H-inden-1-amine
CID 79367211
N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)-2-methylpyridin-3-amine
CID 79367060
6-methoxy-N-(3,4,5-trifluorophenyl)-2,3-dihydro-1H-inden-1-amine
CID 79370051
N-cyclopropyl-6-methoxy-2,3-dihydro-1H-inden-1-amine
CID 79366110
N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)-1,3,4-thiadiazol-2-amine
CID 107648939
N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)-5-methyl-1,3,4-thiadiazol-2-amine
CID 107648480
N-(4-bromo-3,5-dimethylphenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine
CID 107572282
N-(2-chlorophenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine
CID 79366654

Frequently Asked Questions

What is the IUPAC name of 3,6-diethyl-N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)pyrazin-2-amine?
The IUPAC name of 3,6-diethyl-N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)pyrazin-2-amine (CID 22147440) is 3,6-diethyl-N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)pyrazin-2-amine.
What is the SMILES notation for 3,6-diethyl-N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)pyrazin-2-amine?
The canonical SMILES for 3,6-diethyl-N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)pyrazin-2-amine is CCc1cnc(CC)c(NC2CCc3ccc(OC)cc32)n1.
What is the InChIKey of 3,6-diethyl-N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)pyrazin-2-amine?
The InChIKey is YSGKTEIKRRNWQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O/c1-4-13-11-19-16(5-2)18(20-13)21-17-9-7-12-6-8-14(22-3)10-15(12)17/h6,8,10-11,17H,4-5,7,9H2,1-3H3,(H,20,21).
What are the key properties of 3,6-diethyl-N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)pyrazin-2-amine?
3,6-diethyl-N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)pyrazin-2-amine has a molecular weight of 297.40 g/mol, XLogP of 3.71, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-diethyl-N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)pyrazin-2-amine is sourced from PubChem (CID 22147440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).