6-(1-aminoethyl)-N-(1-cyclopropylethyl)-N-methylpyridin-3-amine

C13H21N3 — CID 83122563

IUPAC6-(1-aminoethyl)-N-(1-cyclopropylethyl)-N-methylpyridin-3-amine
SMILESCC(N)c1ccc(N(C)C(C)C2CC2)cn1
InChIInChI=1S/C13H21N3/c1-9(14)13-7-6-12(8-15-13)16(3)10(2)11-4-5-11/h6-11H,4-5,14H2,1-3H3
InChIKeyXWVAXEMQHNIONO-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.34
Rot. Bonds4

About 6-(1-aminoethyl)-N-(1-cyclopropylethyl)-N-methylpyridin-3-amine

6-(1-aminoethyl)-N-(1-cyclopropylethyl)-N-methylpyridin-3-amine (PubChem CID 83122563) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is 6-(1-aminoethyl)-N-(1-cyclopropylethyl)-N-methylpyridin-3-amine.

Molecular Properties

Compound Name6-(1-aminoethyl)-N-(1-cyclopropylethyl)-N-methylpyridin-3-amine
PubChem CID83122563
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC Name6-(1-aminoethyl)-N-(1-cyclopropylethyl)-N-methylpyridin-3-amine
SMILESCC(N)c1ccc(N(C)C(C)C2CC2)cn1
InChIInChI=1S/C13H21N3/c1-9(14)13-7-6-12(8-15-13)16(3)10(2)11-4-5-11/h6-11H,4-5,14H2,1-3H3
InChIKeyXWVAXEMQHNIONO-UHFFFAOYSA-N
XLogP2.34
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(1-aminoethyl)-N-(1-cyclopropylethyl)-N-methylpyridin-3-amine?
The IUPAC name of 6-(1-aminoethyl)-N-(1-cyclopropylethyl)-N-methylpyridin-3-amine (CID 83122563) is 6-(1-aminoethyl)-N-(1-cyclopropylethyl)-N-methylpyridin-3-amine.
What is the SMILES notation for 6-(1-aminoethyl)-N-(1-cyclopropylethyl)-N-methylpyridin-3-amine?
The canonical SMILES for 6-(1-aminoethyl)-N-(1-cyclopropylethyl)-N-methylpyridin-3-amine is CC(N)c1ccc(N(C)C(C)C2CC2)cn1.
What is the InChIKey of 6-(1-aminoethyl)-N-(1-cyclopropylethyl)-N-methylpyridin-3-amine?
The InChIKey is XWVAXEMQHNIONO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-9(14)13-7-6-12(8-15-13)16(3)10(2)11-4-5-11/h6-11H,4-5,14H2,1-3H3.
What are the key properties of 6-(1-aminoethyl)-N-(1-cyclopropylethyl)-N-methylpyridin-3-amine?
6-(1-aminoethyl)-N-(1-cyclopropylethyl)-N-methylpyridin-3-amine has a molecular weight of 219.33 g/mol, XLogP of 2.34, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-aminoethyl)-N-(1-cyclopropylethyl)-N-methylpyridin-3-amine is sourced from PubChem (CID 83122563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).