2-N-[1-(dimethylamino)propan-2-yl]pyrazine-2,6-diamine

C9H17N5 — CID 82949803

IUPAC2-N-[1-(dimethylamino)propan-2-yl]pyrazine-2,6-diamine
SMILESCC(CN(C)C)Nc1cncc(N)n1
InChIInChI=1S/C9H17N5/c1-7(6-14(2)3)12-9-5-11-4-8(10)13-9/h4-5,7H,6H2,1-3H3,(H3,10,12,13)
InChIKeyOXYMEKARTVKPKV-UHFFFAOYSA-N
MW195.27 g/mol
LogP0.42
Rot. Bonds4

About 2-N-[1-(dimethylamino)propan-2-yl]pyrazine-2,6-diamine

2-N-[1-(dimethylamino)propan-2-yl]pyrazine-2,6-diamine (PubChem CID 82949803) has the molecular formula C9H17N5 and a molecular weight of 195.27 g/mol. Its IUPAC name is 2-N-[1-(dimethylamino)propan-2-yl]pyrazine-2,6-diamine.

Molecular Properties

Compound Name2-N-[1-(dimethylamino)propan-2-yl]pyrazine-2,6-diamine
PubChem CID82949803
Molecular FormulaC9H17N5
Molecular Weight195.27 g/mol
Exact Mass195.15
IUPAC Name2-N-[1-(dimethylamino)propan-2-yl]pyrazine-2,6-diamine
SMILESCC(CN(C)C)Nc1cncc(N)n1
InChIInChI=1S/C9H17N5/c1-7(6-14(2)3)12-9-5-11-4-8(10)13-9/h4-5,7H,6H2,1-3H3,(H3,10,12,13)
InChIKeyOXYMEKARTVKPKV-UHFFFAOYSA-N
XLogP0.42
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 50.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-N-[1-(dimethylamino)propan-2-yl]pyrazine-2,6-diamine?
The IUPAC name of 2-N-[1-(dimethylamino)propan-2-yl]pyrazine-2,6-diamine (CID 82949803) is 2-N-[1-(dimethylamino)propan-2-yl]pyrazine-2,6-diamine.
What is the SMILES notation for 2-N-[1-(dimethylamino)propan-2-yl]pyrazine-2,6-diamine?
The canonical SMILES for 2-N-[1-(dimethylamino)propan-2-yl]pyrazine-2,6-diamine is CC(CN(C)C)Nc1cncc(N)n1.
What is the InChIKey of 2-N-[1-(dimethylamino)propan-2-yl]pyrazine-2,6-diamine?
The InChIKey is OXYMEKARTVKPKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N5/c1-7(6-14(2)3)12-9-5-11-4-8(10)13-9/h4-5,7H,6H2,1-3H3,(H3,10,12,13).
What are the key properties of 2-N-[1-(dimethylamino)propan-2-yl]pyrazine-2,6-diamine?
2-N-[1-(dimethylamino)propan-2-yl]pyrazine-2,6-diamine has a molecular weight of 195.27 g/mol, XLogP of 0.42, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-[1-(dimethylamino)propan-2-yl]pyrazine-2,6-diamine is sourced from PubChem (CID 82949803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).