5-ethenyl-1,2,3,4-tetrahydropyridin-6-amine

C7H12N2 — CID 134341808

IUPAC5-ethenyl-1,2,3,4-tetrahydropyridin-6-amine
SMILESC=CC1=C(N)NCCC1
InChIInChI=1S/C7H12N2/c1-2-6-4-3-5-9-7(6)8/h2,9H,1,3-5,8H2
InChIKeyMYHGEQMFBPCAIT-UHFFFAOYSA-N
MW124.19 g/mol
LogP0.73
Rot. Bonds1

About 5-ethenyl-1,2,3,4-tetrahydropyridin-6-amine

5-ethenyl-1,2,3,4-tetrahydropyridin-6-amine (PubChem CID 134341808) has the molecular formula C7H12N2 and a molecular weight of 124.19 g/mol. Its IUPAC name is 5-ethenyl-1,2,3,4-tetrahydropyridin-6-amine.

Molecular Properties

Compound Name5-ethenyl-1,2,3,4-tetrahydropyridin-6-amine
PubChem CID134341808
Molecular FormulaC7H12N2
Molecular Weight124.19 g/mol
Exact Mass124.10
IUPAC Name5-ethenyl-1,2,3,4-tetrahydropyridin-6-amine
SMILESC=CC1=C(N)NCCC1
InChIInChI=1S/C7H12N2/c1-2-6-4-3-5-9-7(6)8/h2,9H,1,3-5,8H2
InChIKeyMYHGEQMFBPCAIT-UHFFFAOYSA-N
XLogP0.73
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.19
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-ethenyl-1,2,3,4-tetrahydropyridin-6-amine?
The IUPAC name of 5-ethenyl-1,2,3,4-tetrahydropyridin-6-amine (CID 134341808) is 5-ethenyl-1,2,3,4-tetrahydropyridin-6-amine.
What is the SMILES notation for 5-ethenyl-1,2,3,4-tetrahydropyridin-6-amine?
The canonical SMILES for 5-ethenyl-1,2,3,4-tetrahydropyridin-6-amine is C=CC1=C(N)NCCC1.
What is the InChIKey of 5-ethenyl-1,2,3,4-tetrahydropyridin-6-amine?
The InChIKey is MYHGEQMFBPCAIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2/c1-2-6-4-3-5-9-7(6)8/h2,9H,1,3-5,8H2.
What are the key properties of 5-ethenyl-1,2,3,4-tetrahydropyridin-6-amine?
5-ethenyl-1,2,3,4-tetrahydropyridin-6-amine has a molecular weight of 124.19 g/mol, XLogP of 0.73, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethenyl-1,2,3,4-tetrahydropyridin-6-amine is sourced from PubChem (CID 134341808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).