6-N-propyl-2-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazine-2,6-diamine

C17H22N4 — CID 80798375

IUPAC6-N-propyl-2-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazine-2,6-diamine
SMILESCCCNc1cncc(NC2CCc3ccccc3C2)n1
InChIInChI=1S/C17H22N4/c1-2-9-19-16-11-18-12-17(21-16)20-15-8-7-13-5-3-4-6-14(13)10-15/h3-6,11-12,15H,2,7-10H2,1H3,(H2,19,20,21)
InChIKeyPSUHFMYNXVFBOZ-UHFFFAOYSA-N
MW282.39 g/mol
LogP3.27
Rot. Bonds5

About 6-N-propyl-2-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazine-2,6-diamine

6-N-propyl-2-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazine-2,6-diamine (PubChem CID 80798375) has the molecular formula C17H22N4 and a molecular weight of 282.39 g/mol. Its IUPAC name is 6-N-propyl-2-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazine-2,6-diamine.

Molecular Properties

Compound Name6-N-propyl-2-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazine-2,6-diamine
PubChem CID80798375
Molecular FormulaC17H22N4
Molecular Weight282.39 g/mol
Exact Mass282.18
IUPAC Name6-N-propyl-2-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazine-2,6-diamine
SMILESCCCNc1cncc(NC2CCc3ccccc3C2)n1
InChIInChI=1S/C17H22N4/c1-2-9-19-16-11-18-12-17(21-16)20-15-8-7-13-5-3-4-6-14(13)10-15/h3-6,11-12,15H,2,7-10H2,1H3,(H2,19,20,21)
InChIKeyPSUHFMYNXVFBOZ-UHFFFAOYSA-N
XLogP3.27
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-N-propyl-6-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-2,6-diamine
CID 80797857
6-N-methyl-2-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazine-2,6-diamine
CID 80825956
2-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazine-2,6-diamine
CID 78988868
6-N-(2,3-dihydro-1H-inden-2-yl)-2-N-propylpyridine-2,6-diamine
CID 107855439
4-[[6-(propylamino)pyrazin-2-yl]amino]cyclohexan-1-ol
CID 80770120
methyl 6-(1,2,3,4-tetrahydronaphthalen-2-ylamino)pyrazine-2-carboxylate
CID 66457314
N-propyl-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrazin-2-amine
CID 80823221
2-N-(1,1-dioxothiolan-3-yl)-6-N-propylpyrazine-2,6-diamine
CID 80786198
2-N-(3-ethylcyclohexyl)-6-N-propylpyrazine-2,6-diamine
CID 80840757
2-N-(2,3-dimethylcyclohexyl)-6-N-propylpyrazine-2,6-diamine
CID 80777015
N-propyl-2-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrimidin-4-amine
CID 65403467
2-N-(1-ethylpiperidin-3-yl)-6-N-propylpyrazine-2,6-diamine
CID 80800932

Frequently Asked Questions

What is the IUPAC name of 6-N-propyl-2-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazine-2,6-diamine?
The IUPAC name of 6-N-propyl-2-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazine-2,6-diamine (CID 80798375) is 6-N-propyl-2-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazine-2,6-diamine.
What is the SMILES notation for 6-N-propyl-2-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazine-2,6-diamine?
The canonical SMILES for 6-N-propyl-2-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazine-2,6-diamine is CCCNc1cncc(NC2CCc3ccccc3C2)n1.
What is the InChIKey of 6-N-propyl-2-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazine-2,6-diamine?
The InChIKey is PSUHFMYNXVFBOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4/c1-2-9-19-16-11-18-12-17(21-16)20-15-8-7-13-5-3-4-6-14(13)10-15/h3-6,11-12,15H,2,7-10H2,1H3,(H2,19,20,21).
What are the key properties of 6-N-propyl-2-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazine-2,6-diamine?
6-N-propyl-2-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazine-2,6-diamine has a molecular weight of 282.39 g/mol, XLogP of 3.27, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-propyl-2-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazine-2,6-diamine is sourced from PubChem (CID 80798375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).