2-N-[2-(diethylamino)ethyl]-6-N-propylpyrazine-2,6-diamine

C13H25N5 — CID 80769930

IUPAC2-N-[2-(diethylamino)ethyl]-6-N-propylpyrazine-2,6-diamine
SMILESCCCNc1cncc(NCCN(CC)CC)n1
InChIInChI=1S/C13H25N5/c1-4-7-15-12-10-14-11-13(17-12)16-8-9-18(5-2)6-3/h10-11H,4-9H2,1-3H3,(H2,15,16,17)
InChIKeyOUAGOMQDTRMTLK-UHFFFAOYSA-N
MW251.38 g/mol
LogP2.05
Rot. Bonds9

About 2-N-[2-(diethylamino)ethyl]-6-N-propylpyrazine-2,6-diamine

2-N-[2-(diethylamino)ethyl]-6-N-propylpyrazine-2,6-diamine (PubChem CID 80769930) has the molecular formula C13H25N5 and a molecular weight of 251.38 g/mol. Its IUPAC name is 2-N-[2-(diethylamino)ethyl]-6-N-propylpyrazine-2,6-diamine.

Molecular Properties

Compound Name2-N-[2-(diethylamino)ethyl]-6-N-propylpyrazine-2,6-diamine
PubChem CID80769930
Molecular FormulaC13H25N5
Molecular Weight251.38 g/mol
Exact Mass251.21
IUPAC Name2-N-[2-(diethylamino)ethyl]-6-N-propylpyrazine-2,6-diamine
SMILESCCCNc1cncc(NCCN(CC)CC)n1
InChIInChI=1S/C13H25N5/c1-4-7-15-12-10-14-11-13(17-12)16-8-9-18(5-2)6-3/h10-11H,4-9H2,1-3H3,(H2,15,16,17)
InChIKeyOUAGOMQDTRMTLK-UHFFFAOYSA-N
XLogP2.05
TPSA53.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.38
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-[2-(diethylamino)ethylsulfanyl]-N-propylpyrazin-2-amine
CID 80890192
2-N-[2-[di(propan-2-yl)amino]ethyl]-6-N-propylpyrazine-2,6-diamine
CID 80770603
4-N-[2-(diethylamino)ethyl]-6-N,2-dipropylpyrimidine-4,6-diamine
CID 80940577
6-chloro-N-propylpyrazin-2-amine
CID 26370207
6-N-propyl-2-N-(2,2,2-trifluoroethyl)pyrazine-2,6-diamine
CID 80785273
2-N-(2-propan-2-yloxyethyl)-6-N-propylpyrazine-2,6-diamine
CID 104766984
4-N-[3-(diethylamino)propyl]-6-N-propylpyrimidine-2,4,6-triamine
CID 80778408
2-[2-hydroxyethyl-[6-(propylamino)pyrazin-2-yl]amino]ethanol
CID 80797495
4-N-[3-(diethylamino)propyl]-2-ethyl-6-N-propylpyrimidine-4,6-diamine
CID 80939676
2-N-ethyl-2-N-(2-methoxyethyl)-6-N-propylpyrazine-2,6-diamine
CID 80808373
2-N,9-N-bis[2-(diethylamino)ethyl]-1,10-phenanthroline-2,9-diamine
CID 100984113
2-[propyl-[6-(propylamino)pyrazin-2-yl]amino]ethanol
CID 80796692

Frequently Asked Questions

What is the IUPAC name of 2-N-[2-(diethylamino)ethyl]-6-N-propylpyrazine-2,6-diamine?
The IUPAC name of 2-N-[2-(diethylamino)ethyl]-6-N-propylpyrazine-2,6-diamine (CID 80769930) is 2-N-[2-(diethylamino)ethyl]-6-N-propylpyrazine-2,6-diamine.
What is the SMILES notation for 2-N-[2-(diethylamino)ethyl]-6-N-propylpyrazine-2,6-diamine?
The canonical SMILES for 2-N-[2-(diethylamino)ethyl]-6-N-propylpyrazine-2,6-diamine is CCCNc1cncc(NCCN(CC)CC)n1.
What is the InChIKey of 2-N-[2-(diethylamino)ethyl]-6-N-propylpyrazine-2,6-diamine?
The InChIKey is OUAGOMQDTRMTLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N5/c1-4-7-15-12-10-14-11-13(17-12)16-8-9-18(5-2)6-3/h10-11H,4-9H2,1-3H3,(H2,15,16,17).
What are the key properties of 2-N-[2-(diethylamino)ethyl]-6-N-propylpyrazine-2,6-diamine?
2-N-[2-(diethylamino)ethyl]-6-N-propylpyrazine-2,6-diamine has a molecular weight of 251.38 g/mol, XLogP of 2.05, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-[2-(diethylamino)ethyl]-6-N-propylpyrazine-2,6-diamine is sourced from PubChem (CID 80769930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).