3-prop-2-enylpyridin-2-amine

C8H10N2 — CID 22022139

IUPAC3-prop-2-enylpyridin-2-amine
SMILESC=CCc1cccnc1N
InChIInChI=1S/C8H10N2/c1-2-4-7-5-3-6-10-8(7)9/h2-3,5-6H,1,4H2,(H2,9,10)
InChIKeySTNGSTRPQSKZPG-UHFFFAOYSA-N
MW134.18 g/mol
LogP1.39
Rot. Bonds2

About 3-prop-2-enylpyridin-2-amine

3-prop-2-enylpyridin-2-amine (PubChem CID 22022139) has the molecular formula C8H10N2 and a molecular weight of 134.18 g/mol. Its IUPAC name is 3-prop-2-enylpyridin-2-amine.

Molecular Properties

Compound Name3-prop-2-enylpyridin-2-amine
PubChem CID22022139
Molecular FormulaC8H10N2
Molecular Weight134.18 g/mol
Exact Mass134.08
IUPAC Name3-prop-2-enylpyridin-2-amine
SMILESC=CCc1cccnc1N
InChIInChI=1S/C8H10N2/c1-2-4-7-5-3-6-10-8(7)9/h2-3,5-6H,1,4H2,(H2,9,10)
InChIKeySTNGSTRPQSKZPG-UHFFFAOYSA-N
XLogP1.39
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.18
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

palladium(2+);2-prop-2-enylaniline;dichloride
CID 3036591
3-(methylsulfonylmethyl)pyridin-2-amine
CID 117212620
3-prop-2-enyl-2-pyridin-2-ylpyridine
CID 66633912
2-prop-2-enylaniline
CID 3036592
3,3-difluoroprop-1-ene;3-(2-methylpropyl)pyridin-2-amine
CID 176663812
phosphane;3-prop-2-enyl-2-pyridin-2-ylpyridine
CID 175044718
2-hydroxyethylidenetungsten;methane;2-prop-2-enylaniline
CID 161486052
3-N-prop-2-enylpyridine-2,3-diamine
CID 104540292
(2-amino-3-pyridinyl)methyl formate
CID 174668609
ethane;3-propylpyridin-2-amine
CID 176926436
3-(2-methylpropyl)pyridin-2-amine
CID 20771927
(2-amino-4-prop-2-enyl-3-pyridinyl) formate
CID 175459901

Frequently Asked Questions

What is the IUPAC name of 3-prop-2-enylpyridin-2-amine?
The IUPAC name of 3-prop-2-enylpyridin-2-amine (CID 22022139) is 3-prop-2-enylpyridin-2-amine.
What is the SMILES notation for 3-prop-2-enylpyridin-2-amine?
The canonical SMILES for 3-prop-2-enylpyridin-2-amine is C=CCc1cccnc1N.
What is the InChIKey of 3-prop-2-enylpyridin-2-amine?
The InChIKey is STNGSTRPQSKZPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2/c1-2-4-7-5-3-6-10-8(7)9/h2-3,5-6H,1,4H2,(H2,9,10).
What are the key properties of 3-prop-2-enylpyridin-2-amine?
3-prop-2-enylpyridin-2-amine has a molecular weight of 134.18 g/mol, XLogP of 1.39, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-prop-2-enylpyridin-2-amine is sourced from PubChem (CID 22022139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).