6-N-ethyl-2-N-(2-pyrrolidin-1-ylethyl)pyrazine-2,6-diamine

C12H21N5 — CID 78990309

IUPAC6-N-ethyl-2-N-(2-pyrrolidin-1-ylethyl)pyrazine-2,6-diamine
SMILESCCNc1cncc(NCCN2CCCC2)n1
InChIInChI=1S/C12H21N5/c1-2-14-11-9-13-10-12(16-11)15-5-8-17-6-3-4-7-17/h9-10H,2-8H2,1H3,(H2,14,15,16)
InChIKeyOPDDLMCPJZYTLA-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.42
Rot. Bonds6

About 6-N-ethyl-2-N-(2-pyrrolidin-1-ylethyl)pyrazine-2,6-diamine

6-N-ethyl-2-N-(2-pyrrolidin-1-ylethyl)pyrazine-2,6-diamine (PubChem CID 78990309) has the molecular formula C12H21N5 and a molecular weight of 235.33 g/mol. Its IUPAC name is 6-N-ethyl-2-N-(2-pyrrolidin-1-ylethyl)pyrazine-2,6-diamine.

Molecular Properties

Compound Name6-N-ethyl-2-N-(2-pyrrolidin-1-ylethyl)pyrazine-2,6-diamine
PubChem CID78990309
Molecular FormulaC12H21N5
Molecular Weight235.33 g/mol
Exact Mass235.18
IUPAC Name6-N-ethyl-2-N-(2-pyrrolidin-1-ylethyl)pyrazine-2,6-diamine
SMILESCCNc1cncc(NCCN2CCCC2)n1
InChIInChI=1S/C12H21N5/c1-2-14-11-9-13-10-12(16-11)15-5-8-17-6-3-4-7-17/h9-10H,2-8H2,1H3,(H2,14,15,16)
InChIKeyOPDDLMCPJZYTLA-UHFFFAOYSA-N
XLogP1.42
TPSA53.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-N-ethyl-6-N-(2-pyrrolidin-1-ylethyl)-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102718349
3-N-ethyl-5-N-(2-pyrrolidin-1-ylethyl)pyridine-3,5-diamine
CID 113423980
6-N-methyl-2-N-(2-thiomorpholin-4-ylethyl)pyrazine-2,6-diamine
CID 114174033
2-N-ethyl-4-N-(2-pyrrolidin-1-ylethyl)pyrimidine-2,4-diamine
CID 80833263
2-N-piperidin-1-yl-6-N-propylpyrazine-2,6-diamine
CID 83027760
2-N-methyl-6-N-(2-pyrrolidin-1-ylethyl)pyridine-2,6-diamine
CID 80832526
2-ethyl-6-N-propyl-4-N-(2-pyrrolidin-1-ylethyl)pyrimidine-4,6-diamine
CID 80934686
6-(3-pyrrolidin-1-ylpropylamino)pyrazine-2-carboxylic acid
CID 66452088
2-[4-[6-(ethylamino)pyrazin-2-yl]piperazin-1-yl]ethanol
CID 78990415
6-N-ethyl-2-N-(3-methylbutyl)pyrazine-2,6-diamine
CID 78917989
6-chloro-2-propyl-N-(2-pyrrolidin-1-ylethyl)pyrimidin-4-amine
CID 80939981
3,5-dichloro-2-N-ethyl-6-N-(2-pyrrolidin-1-ylethyl)pyridine-2,6-diamine
CID 102757956

Frequently Asked Questions

What is the IUPAC name of 6-N-ethyl-2-N-(2-pyrrolidin-1-ylethyl)pyrazine-2,6-diamine?
The IUPAC name of 6-N-ethyl-2-N-(2-pyrrolidin-1-ylethyl)pyrazine-2,6-diamine (CID 78990309) is 6-N-ethyl-2-N-(2-pyrrolidin-1-ylethyl)pyrazine-2,6-diamine.
What is the SMILES notation for 6-N-ethyl-2-N-(2-pyrrolidin-1-ylethyl)pyrazine-2,6-diamine?
The canonical SMILES for 6-N-ethyl-2-N-(2-pyrrolidin-1-ylethyl)pyrazine-2,6-diamine is CCNc1cncc(NCCN2CCCC2)n1.
What is the InChIKey of 6-N-ethyl-2-N-(2-pyrrolidin-1-ylethyl)pyrazine-2,6-diamine?
The InChIKey is OPDDLMCPJZYTLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5/c1-2-14-11-9-13-10-12(16-11)15-5-8-17-6-3-4-7-17/h9-10H,2-8H2,1H3,(H2,14,15,16).
What are the key properties of 6-N-ethyl-2-N-(2-pyrrolidin-1-ylethyl)pyrazine-2,6-diamine?
6-N-ethyl-2-N-(2-pyrrolidin-1-ylethyl)pyrazine-2,6-diamine has a molecular weight of 235.33 g/mol, XLogP of 1.42, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-ethyl-2-N-(2-pyrrolidin-1-ylethyl)pyrazine-2,6-diamine is sourced from PubChem (CID 78990309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).