2-N-(1-ethylpiperidin-3-yl)-6-N-propylpyrazine-2,6-diamine

C14H25N5 — CID 80800932

IUPAC2-N-(1-ethylpiperidin-3-yl)-6-N-propylpyrazine-2,6-diamine
SMILESCCCNc1cncc(NC2CCCN(CC)C2)n1
InChIInChI=1S/C14H25N5/c1-3-7-16-13-9-15-10-14(18-13)17-12-6-5-8-19(4-2)11-12/h9-10,12H,3-8,11H2,1-2H3,(H2,16,17,18)
InChIKeyGDAUFTINBMAQJC-UHFFFAOYSA-N
MW263.39 g/mol
LogP2.19
Rot. Bonds6

About 2-N-(1-ethylpiperidin-3-yl)-6-N-propylpyrazine-2,6-diamine

2-N-(1-ethylpiperidin-3-yl)-6-N-propylpyrazine-2,6-diamine (PubChem CID 80800932) has the molecular formula C14H25N5 and a molecular weight of 263.39 g/mol. Its IUPAC name is 2-N-(1-ethylpiperidin-3-yl)-6-N-propylpyrazine-2,6-diamine.

Molecular Properties

Compound Name2-N-(1-ethylpiperidin-3-yl)-6-N-propylpyrazine-2,6-diamine
PubChem CID80800932
Molecular FormulaC14H25N5
Molecular Weight263.39 g/mol
Exact Mass263.21
IUPAC Name2-N-(1-ethylpiperidin-3-yl)-6-N-propylpyrazine-2,6-diamine
SMILESCCCNc1cncc(NC2CCCN(CC)C2)n1
InChIInChI=1S/C14H25N5/c1-3-7-16-13-9-15-10-14(18-13)17-12-6-5-8-19(4-2)11-12/h9-10,12H,3-8,11H2,1-2H3,(H2,16,17,18)
InChIKeyGDAUFTINBMAQJC-UHFFFAOYSA-N
XLogP2.19
TPSA53.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.39
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1-ethylpiperidin-3-yl)-5,6-dimethylpyrazin-2-amine
CID 114475474
2-N-(3-ethylcyclohexyl)-6-N-propylpyrazine-2,6-diamine
CID 80840757
4-[[6-(propylamino)pyrazin-2-yl]amino]cyclohexan-1-ol
CID 80770120
2-N-(1-azabicyclo[2.2.2]octan-3-yl)-6-N-propylpyrazine-2,6-diamine
CID 80778324
6-N-ethyl-4-N-(1-ethylpiperidin-3-yl)-2-propylpyrimidine-4,6-diamine
CID 80941716
N-(1-ethylpiperidin-3-yl)-2-methylpyrimidin-4-amine
CID 62786064
N-(1-ethylpiperidin-3-yl)-5-fluoropyridin-2-amine
CID 61313341
5-chloro-N-(1-ethylpiperidin-3-yl)pyridin-2-amine
CID 61170004
2-N-(1,1-dioxothiolan-3-yl)-6-N-propylpyrazine-2,6-diamine
CID 80786198
2-N-(2,3-dimethylcyclohexyl)-6-N-propylpyrazine-2,6-diamine
CID 80777015
2-N-[(1-methylpyrrolidin-3-yl)methyl]-6-N-propylpyrazine-2,6-diamine
CID 80791122
6-(3-ethylpiperidin-1-yl)-N-propylpyrazin-2-amine
CID 80793558

Frequently Asked Questions

What is the IUPAC name of 2-N-(1-ethylpiperidin-3-yl)-6-N-propylpyrazine-2,6-diamine?
The IUPAC name of 2-N-(1-ethylpiperidin-3-yl)-6-N-propylpyrazine-2,6-diamine (CID 80800932) is 2-N-(1-ethylpiperidin-3-yl)-6-N-propylpyrazine-2,6-diamine.
What is the SMILES notation for 2-N-(1-ethylpiperidin-3-yl)-6-N-propylpyrazine-2,6-diamine?
The canonical SMILES for 2-N-(1-ethylpiperidin-3-yl)-6-N-propylpyrazine-2,6-diamine is CCCNc1cncc(NC2CCCN(CC)C2)n1.
What is the InChIKey of 2-N-(1-ethylpiperidin-3-yl)-6-N-propylpyrazine-2,6-diamine?
The InChIKey is GDAUFTINBMAQJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5/c1-3-7-16-13-9-15-10-14(18-13)17-12-6-5-8-19(4-2)11-12/h9-10,12H,3-8,11H2,1-2H3,(H2,16,17,18).
What are the key properties of 2-N-(1-ethylpiperidin-3-yl)-6-N-propylpyrazine-2,6-diamine?
2-N-(1-ethylpiperidin-3-yl)-6-N-propylpyrazine-2,6-diamine has a molecular weight of 263.39 g/mol, XLogP of 2.19, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(1-ethylpiperidin-3-yl)-6-N-propylpyrazine-2,6-diamine is sourced from PubChem (CID 80800932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).