N-ethenyl-4-propan-2-yl-3,5-dihydro-2H-pyrazin-6-amine

C9H17N3 — CID 164836760

IUPACN-ethenyl-4-propan-2-yl-3,5-dihydro-2H-pyrazin-6-amine
SMILESC=CNC1=NCCN(C(C)C)C1
InChIInChI=1S/C9H17N3/c1-4-10-9-7-12(8(2)3)6-5-11-9/h4,8H,1,5-7H2,2-3H3,(H,10,11)
InChIKeyVDGSGUNWQGTBMJ-UHFFFAOYSA-N
MW167.26 g/mol
LogP0.84
Rot. Bonds2

About N-ethenyl-4-propan-2-yl-3,5-dihydro-2H-pyrazin-6-amine

N-ethenyl-4-propan-2-yl-3,5-dihydro-2H-pyrazin-6-amine (PubChem CID 164836760) has the molecular formula C9H17N3 and a molecular weight of 167.26 g/mol. Its IUPAC name is N-ethenyl-4-propan-2-yl-3,5-dihydro-2H-pyrazin-6-amine.

Molecular Properties

Compound NameN-ethenyl-4-propan-2-yl-3,5-dihydro-2H-pyrazin-6-amine
PubChem CID164836760
Molecular FormulaC9H17N3
Molecular Weight167.26 g/mol
Exact Mass167.14
IUPAC NameN-ethenyl-4-propan-2-yl-3,5-dihydro-2H-pyrazin-6-amine
SMILESC=CNC1=NCCN(C(C)C)C1
InChIInChI=1S/C9H17N3/c1-4-10-9-7-12(8(2)3)6-5-11-9/h4,8H,1,5-7H2,2-3H3,(H,10,11)
InChIKeyVDGSGUNWQGTBMJ-UHFFFAOYSA-N
XLogP0.84
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.26
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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2-Methyl-1,2-dihydropyrazin-3-amine
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N-ethenyl-N'-methyl-2-(propylamino)propanimidamide
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1-(3-methylpiperazin-1-yl)-N-prop-1-enylpropan-1-imine
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N-ethenyl-N'-propan-2-ylpropanimidamide
CID 123604400
N-ethenyl-1-piperazin-1-ylethanimine
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Frequently Asked Questions

What is the IUPAC name of N-ethenyl-4-propan-2-yl-3,5-dihydro-2H-pyrazin-6-amine?
The IUPAC name of N-ethenyl-4-propan-2-yl-3,5-dihydro-2H-pyrazin-6-amine (CID 164836760) is N-ethenyl-4-propan-2-yl-3,5-dihydro-2H-pyrazin-6-amine.
What is the SMILES notation for N-ethenyl-4-propan-2-yl-3,5-dihydro-2H-pyrazin-6-amine?
The canonical SMILES for N-ethenyl-4-propan-2-yl-3,5-dihydro-2H-pyrazin-6-amine is C=CNC1=NCCN(C(C)C)C1.
What is the InChIKey of N-ethenyl-4-propan-2-yl-3,5-dihydro-2H-pyrazin-6-amine?
The InChIKey is VDGSGUNWQGTBMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3/c1-4-10-9-7-12(8(2)3)6-5-11-9/h4,8H,1,5-7H2,2-3H3,(H,10,11).
What are the key properties of N-ethenyl-4-propan-2-yl-3,5-dihydro-2H-pyrazin-6-amine?
N-ethenyl-4-propan-2-yl-3,5-dihydro-2H-pyrazin-6-amine has a molecular weight of 167.26 g/mol, XLogP of 0.84, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-4-propan-2-yl-3,5-dihydro-2H-pyrazin-6-amine is sourced from PubChem (CID 164836760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).