2-N-[2-[di(propan-2-yl)amino]ethyl]-6-N-propylpyrazine-2,6-diamine

C15H29N5 — CID 80770603

IUPAC2-N-[2-[di(propan-2-yl)amino]ethyl]-6-N-propylpyrazine-2,6-diamine
SMILESCCCNc1cncc(NCCN(C(C)C)C(C)C)n1
InChIInChI=1S/C15H29N5/c1-6-7-17-14-10-16-11-15(19-14)18-8-9-20(12(2)3)13(4)5/h10-13H,6-9H2,1-5H3,(H2,17,18,19)
InChIKeyMOIPFZAQHDMWNZ-UHFFFAOYSA-N
MW279.43 g/mol
LogP2.83
Rot. Bonds9

About 2-N-[2-[di(propan-2-yl)amino]ethyl]-6-N-propylpyrazine-2,6-diamine

2-N-[2-[di(propan-2-yl)amino]ethyl]-6-N-propylpyrazine-2,6-diamine (PubChem CID 80770603) has the molecular formula C15H29N5 and a molecular weight of 279.43 g/mol. Its IUPAC name is 2-N-[2-[di(propan-2-yl)amino]ethyl]-6-N-propylpyrazine-2,6-diamine.

Molecular Properties

Compound Name2-N-[2-[di(propan-2-yl)amino]ethyl]-6-N-propylpyrazine-2,6-diamine
PubChem CID80770603
Molecular FormulaC15H29N5
Molecular Weight279.43 g/mol
Exact Mass279.24
IUPAC Name2-N-[2-[di(propan-2-yl)amino]ethyl]-6-N-propylpyrazine-2,6-diamine
SMILESCCCNc1cncc(NCCN(C(C)C)C(C)C)n1
InChIInChI=1S/C15H29N5/c1-6-7-17-14-10-16-11-15(19-14)18-8-9-20(12(2)3)13(4)5/h10-13H,6-9H2,1-5H3,(H2,17,18,19)
InChIKeyMOIPFZAQHDMWNZ-UHFFFAOYSA-N
XLogP2.83
TPSA53.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.43
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-N-[2-(diethylamino)ethyl]-6-N-propylpyrazine-2,6-diamine
CID 80769930
2-N-(2-propan-2-yloxyethyl)-6-N-propylpyrazine-2,6-diamine
CID 104766984
2-N-(4-propan-2-yloxybutyl)-6-N-propylpyrazine-2,6-diamine
CID 106014673
2-N-[1-(dimethylamino)-3-methylbutan-2-yl]-6-N-propylpyrazine-2,6-diamine
CID 80801033
3-methyl-2-[[6-(propylamino)pyrazin-2-yl]amino]butan-1-ol
CID 80848976
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-propan-2-yl-6-N-propyl-2-N-(2,2,2-trifluoroethyl)pyrazine-2,6-diamine
CID 80814943
6-N-propyl-2-N-(1-pyridin-2-ylethyl)pyrazine-2,6-diamine
CID 80781351
2-[2-hydroxyethyl-[6-(propylamino)pyrazin-2-yl]amino]ethanol
CID 80797495
2-N-ethyl-2-N-(1-methoxypropan-2-yl)-6-N-propylpyrazine-2,6-diamine
CID 80814670
N-(6-chloro-2-propylpyrimidin-4-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine
CID 80940887

Frequently Asked Questions

What is the IUPAC name of 2-N-[2-[di(propan-2-yl)amino]ethyl]-6-N-propylpyrazine-2,6-diamine?
The IUPAC name of 2-N-[2-[di(propan-2-yl)amino]ethyl]-6-N-propylpyrazine-2,6-diamine (CID 80770603) is 2-N-[2-[di(propan-2-yl)amino]ethyl]-6-N-propylpyrazine-2,6-diamine.
What is the SMILES notation for 2-N-[2-[di(propan-2-yl)amino]ethyl]-6-N-propylpyrazine-2,6-diamine?
The canonical SMILES for 2-N-[2-[di(propan-2-yl)amino]ethyl]-6-N-propylpyrazine-2,6-diamine is CCCNc1cncc(NCCN(C(C)C)C(C)C)n1.
What is the InChIKey of 2-N-[2-[di(propan-2-yl)amino]ethyl]-6-N-propylpyrazine-2,6-diamine?
The InChIKey is MOIPFZAQHDMWNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N5/c1-6-7-17-14-10-16-11-15(19-14)18-8-9-20(12(2)3)13(4)5/h10-13H,6-9H2,1-5H3,(H2,17,18,19).
What are the key properties of 2-N-[2-[di(propan-2-yl)amino]ethyl]-6-N-propylpyrazine-2,6-diamine?
2-N-[2-[di(propan-2-yl)amino]ethyl]-6-N-propylpyrazine-2,6-diamine has a molecular weight of 279.43 g/mol, XLogP of 2.83, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-[2-[di(propan-2-yl)amino]ethyl]-6-N-propylpyrazine-2,6-diamine is sourced from PubChem (CID 80770603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).