ethane;3-ethenyl-1H-pyrrol-2-amine

C8H14N2 — CID 178089046

IUPACethane;3-ethenyl-1H-pyrrol-2-amine
SMILESC=Cc1cc[nH]c1N.CC
InChIInChI=1S/C6H8N2.C2H6/c1-2-5-3-4-8-6(5)7;1-2/h2-4,8H,1,7H2;1-2H3
InChIKeyUOJJWXCLVZLLIY-UHFFFAOYSA-N
MW138.21 g/mol
LogP2.27
Rot. Bonds1

About ethane;3-ethenyl-1H-pyrrol-2-amine

ethane;3-ethenyl-1H-pyrrol-2-amine (PubChem CID 178089046) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is ethane;3-ethenyl-1H-pyrrol-2-amine.

Molecular Properties

Compound Nameethane;3-ethenyl-1H-pyrrol-2-amine
PubChem CID178089046
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC Nameethane;3-ethenyl-1H-pyrrol-2-amine
SMILESC=Cc1cc[nH]c1N.CC
InChIInChI=1S/C6H8N2.C2H6/c1-2-5-3-4-8-6(5)7;1-2/h2-4,8H,1,7H2;1-2H3
InChIKeyUOJJWXCLVZLLIY-UHFFFAOYSA-N
XLogP2.27
TPSA41.81 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

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N-(3-ethenyl-1H-pyrrol-2-yl)methanimine
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2-(1-bromoprop-1-enyl)-3-ethenyl-1H-pyrrole
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2-(3-ethenyl-1H-pyrrol-2-yl)ethenyl-methylphosphane
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N-(3-ethenyl-1H-pyrrol-2-yl)propan-1-imine
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1,2-bis(ethenyl)benzene;ethane;prop-1-ene
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3-buta-1,3-dienyl-2-methyl-1H-pyrrole
CID 91256027
3-ethenyl-4-[(Z)-prop-1-enyl]-1H-pyridin-2-one
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CID 144842515

Frequently Asked Questions

What is the IUPAC name of ethane;3-ethenyl-1H-pyrrol-2-amine?
The IUPAC name of ethane;3-ethenyl-1H-pyrrol-2-amine (CID 178089046) is ethane;3-ethenyl-1H-pyrrol-2-amine.
What is the SMILES notation for ethane;3-ethenyl-1H-pyrrol-2-amine?
The canonical SMILES for ethane;3-ethenyl-1H-pyrrol-2-amine is C=Cc1cc[nH]c1N.CC.
What is the InChIKey of ethane;3-ethenyl-1H-pyrrol-2-amine?
The InChIKey is UOJJWXCLVZLLIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2.C2H6/c1-2-5-3-4-8-6(5)7;1-2/h2-4,8H,1,7H2;1-2H3.
What are the key properties of ethane;3-ethenyl-1H-pyrrol-2-amine?
ethane;3-ethenyl-1H-pyrrol-2-amine has a molecular weight of 138.21 g/mol, XLogP of 2.27, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-ethenyl-1H-pyrrol-2-amine is sourced from PubChem (CID 178089046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).