4-(1-aminoethenyl)-N-ethyl-N-propylpyridin-2-amine

C12H19N3 — CID 142584309

IUPAC4-(1-aminoethenyl)-N-ethyl-N-propylpyridin-2-amine
SMILESC=C(N)c1ccnc(N(CC)CCC)c1
InChIInChI=1S/C12H19N3/c1-4-8-15(5-2)12-9-11(10(3)13)6-7-14-12/h6-7,9H,3-5,8,13H2,1-2H3
InChIKeyMCOHLLARJCTJRI-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.25
Rot. Bonds5

About 4-(1-aminoethenyl)-N-ethyl-N-propylpyridin-2-amine

4-(1-aminoethenyl)-N-ethyl-N-propylpyridin-2-amine (PubChem CID 142584309) has the molecular formula C12H19N3 and a molecular weight of 205.30 g/mol. Its IUPAC name is 4-(1-aminoethenyl)-N-ethyl-N-propylpyridin-2-amine.

Molecular Properties

Compound Name4-(1-aminoethenyl)-N-ethyl-N-propylpyridin-2-amine
PubChem CID142584309
Molecular FormulaC12H19N3
Molecular Weight205.30 g/mol
Exact Mass205.16
IUPAC Name4-(1-aminoethenyl)-N-ethyl-N-propylpyridin-2-amine
SMILESC=C(N)c1ccnc(N(CC)CCC)c1
InChIInChI=1S/C12H19N3/c1-4-8-15(5-2)12-9-11(10(3)13)6-7-14-12/h6-7,9H,3-5,8,13H2,1-2H3
InChIKeyMCOHLLARJCTJRI-UHFFFAOYSA-N
XLogP2.25
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(1-aminoethenyl)-N-ethyl-N-propylpyridin-2-amine?
The IUPAC name of 4-(1-aminoethenyl)-N-ethyl-N-propylpyridin-2-amine (CID 142584309) is 4-(1-aminoethenyl)-N-ethyl-N-propylpyridin-2-amine.
What is the SMILES notation for 4-(1-aminoethenyl)-N-ethyl-N-propylpyridin-2-amine?
The canonical SMILES for 4-(1-aminoethenyl)-N-ethyl-N-propylpyridin-2-amine is C=C(N)c1ccnc(N(CC)CCC)c1.
What is the InChIKey of 4-(1-aminoethenyl)-N-ethyl-N-propylpyridin-2-amine?
The InChIKey is MCOHLLARJCTJRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3/c1-4-8-15(5-2)12-9-11(10(3)13)6-7-14-12/h6-7,9H,3-5,8,13H2,1-2H3.
What are the key properties of 4-(1-aminoethenyl)-N-ethyl-N-propylpyridin-2-amine?
4-(1-aminoethenyl)-N-ethyl-N-propylpyridin-2-amine has a molecular weight of 205.30 g/mol, XLogP of 2.25, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-aminoethenyl)-N-ethyl-N-propylpyridin-2-amine is sourced from PubChem (CID 142584309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).