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

C11H17N3 — CID 83122472

IUPAC6-(1-aminoethyl)-N-cyclopropyl-N-methylpyridin-3-amine
SMILESCC(N)c1ccc(N(C)C2CC2)cn1
InChIInChI=1S/C11H17N3/c1-8(12)11-6-5-10(7-13-11)14(2)9-3-4-9/h5-9H,3-4,12H2,1-2H3
InChIKeyMZUKGQDCBFEIOZ-UHFFFAOYSA-N
MW191.28 g/mol
LogP1.70
Rot. Bonds3

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

6-(1-aminoethyl)-N-cyclopropyl-N-methylpyridin-3-amine (PubChem CID 83122472) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 6-(1-aminoethyl)-N-cyclopropyl-N-methylpyridin-3-amine.

Molecular Properties

Compound Name6-(1-aminoethyl)-N-cyclopropyl-N-methylpyridin-3-amine
PubChem CID83122472
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name6-(1-aminoethyl)-N-cyclopropyl-N-methylpyridin-3-amine
SMILESCC(N)c1ccc(N(C)C2CC2)cn1
InChIInChI=1S/C11H17N3/c1-8(12)11-6-5-10(7-13-11)14(2)9-3-4-9/h5-9H,3-4,12H2,1-2H3
InChIKeyMZUKGQDCBFEIOZ-UHFFFAOYSA-N
XLogP1.70
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 51.70
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-cyclopropyl-N-methylpyridin-3-amine?
The IUPAC name of 6-(1-aminoethyl)-N-cyclopropyl-N-methylpyridin-3-amine (CID 83122472) is 6-(1-aminoethyl)-N-cyclopropyl-N-methylpyridin-3-amine.
What is the SMILES notation for 6-(1-aminoethyl)-N-cyclopropyl-N-methylpyridin-3-amine?
The canonical SMILES for 6-(1-aminoethyl)-N-cyclopropyl-N-methylpyridin-3-amine is CC(N)c1ccc(N(C)C2CC2)cn1.
What is the InChIKey of 6-(1-aminoethyl)-N-cyclopropyl-N-methylpyridin-3-amine?
The InChIKey is MZUKGQDCBFEIOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-8(12)11-6-5-10(7-13-11)14(2)9-3-4-9/h5-9H,3-4,12H2,1-2H3.
What are the key properties of 6-(1-aminoethyl)-N-cyclopropyl-N-methylpyridin-3-amine?
6-(1-aminoethyl)-N-cyclopropyl-N-methylpyridin-3-amine has a molecular weight of 191.28 g/mol, XLogP of 1.70, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-aminoethyl)-N-cyclopropyl-N-methylpyridin-3-amine is sourced from PubChem (CID 83122472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).