ethane;6-(1-pyrrolidin-1-ylethenyl)pyridin-3-amine

C13H21N3 — CID 144929171

IUPACethane;6-(1-pyrrolidin-1-ylethenyl)pyridin-3-amine
SMILESC=C(c1ccc(N)cn1)N1CCCC1.CC
InChIInChI=1S/C11H15N3.C2H6/c1-9(14-6-2-3-7-14)11-5-4-10(12)8-13-11;1-2/h4-5,8H,1-3,6-7,12H2;1-2H3
InChIKeyUBAOTHSIBKLFCA-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.76
Rot. Bonds2

About ethane;6-(1-pyrrolidin-1-ylethenyl)pyridin-3-amine

ethane;6-(1-pyrrolidin-1-ylethenyl)pyridin-3-amine (PubChem CID 144929171) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is ethane;6-(1-pyrrolidin-1-ylethenyl)pyridin-3-amine.

Molecular Properties

Compound Nameethane;6-(1-pyrrolidin-1-ylethenyl)pyridin-3-amine
PubChem CID144929171
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC Nameethane;6-(1-pyrrolidin-1-ylethenyl)pyridin-3-amine
SMILESC=C(c1ccc(N)cn1)N1CCCC1.CC
InChIInChI=1S/C11H15N3.C2H6/c1-9(14-6-2-3-7-14)11-5-4-10(12)8-13-11;1-2/h4-5,8H,1-3,6-7,12H2;1-2H3
InChIKeyUBAOTHSIBKLFCA-UHFFFAOYSA-N
XLogP2.76
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-prop-1-en-2-ylpyridin-3-amine
CID 66520228
5-amino-N-(1-oxo-1-piperidin-1-ylpropan-2-yl)pyridine-2-carboxamide
CID 81315636
(5-amino-2-pyridinyl)-(2-methylpiperidin-1-yl)methanone
CID 81319885
(5-amino-2-pyridinyl)-[(3S)-3-hydroxypiperidin-1-yl]methanone
CID 107211702
[2-(azepan-1-yl)-2-oxoethyl] 5-aminopyridine-2-carboxylate
CID 81316115
N-[1-(5-aminopyridine-2-carbonyl)piperidin-4-yl]cyclopropanecarboxamide
CID 81310797
(5-amino-2-pyridinyl)-[2-(hydroxymethyl)azepan-1-yl]methanone
CID 116633795
(5-amino-2-pyridinyl)-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]methanone
CID 81316793
(5-amino-2-pyridinyl)-(4-methylcyclohexyl)methanone
CID 116605314
(5-amino-2-pyridinyl)-(3,3-difluoropyrrolidin-1-yl)methanone
CID 138985813
(5-amino-2-pyridinyl)-(3-iodopyrrolidin-1-yl)methanone
CID 149181615
2-(1-methylpiperidin-2-yl)ethyl 5-aminopyridine-2-carboxylate
CID 104934308

Frequently Asked Questions

What is the IUPAC name of ethane;6-(1-pyrrolidin-1-ylethenyl)pyridin-3-amine?
The IUPAC name of ethane;6-(1-pyrrolidin-1-ylethenyl)pyridin-3-amine (CID 144929171) is ethane;6-(1-pyrrolidin-1-ylethenyl)pyridin-3-amine.
What is the SMILES notation for ethane;6-(1-pyrrolidin-1-ylethenyl)pyridin-3-amine?
The canonical SMILES for ethane;6-(1-pyrrolidin-1-ylethenyl)pyridin-3-amine is C=C(c1ccc(N)cn1)N1CCCC1.CC.
What is the InChIKey of ethane;6-(1-pyrrolidin-1-ylethenyl)pyridin-3-amine?
The InChIKey is UBAOTHSIBKLFCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3.C2H6/c1-9(14-6-2-3-7-14)11-5-4-10(12)8-13-11;1-2/h4-5,8H,1-3,6-7,12H2;1-2H3.
What are the key properties of ethane;6-(1-pyrrolidin-1-ylethenyl)pyridin-3-amine?
ethane;6-(1-pyrrolidin-1-ylethenyl)pyridin-3-amine has a molecular weight of 219.33 g/mol, XLogP of 2.76, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;6-(1-pyrrolidin-1-ylethenyl)pyridin-3-amine is sourced from PubChem (CID 144929171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).