(1S)-1-(2,4,6-trimethyl-3-pyridinyl)ethanamine

C10H16N2 — CID 63750724

IUPAC(1S)-1-(2,4,6-trimethyl-3-pyridinyl)ethanamine
SMILESCc1cc(C)c([C@H](C)N)c(C)n1
InChIInChI=1S/C10H16N2/c1-6-5-7(2)12-9(4)10(6)8(3)11/h5,8H,11H2,1-4H3/t8-/m0/s1
InChIKeyKJNAQWCCUUDFNC-QMMMGPOBSA-N
MW164.25 g/mol
LogP2.03
Rot. Bonds1

About (1S)-1-(2,4,6-trimethyl-3-pyridinyl)ethanamine

(1S)-1-(2,4,6-trimethyl-3-pyridinyl)ethanamine (PubChem CID 63750724) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is (1S)-1-(2,4,6-trimethyl-3-pyridinyl)ethanamine.

Molecular Properties

Compound Name(1S)-1-(2,4,6-trimethyl-3-pyridinyl)ethanamine
PubChem CID63750724
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name(1S)-1-(2,4,6-trimethyl-3-pyridinyl)ethanamine
SMILESCc1cc(C)c([C@H](C)N)c(C)n1
InChIInChI=1S/C10H16N2/c1-6-5-7(2)12-9(4)10(6)8(3)11/h5,8H,11H2,1-4H3/t8-/m0/s1
InChIKeyKJNAQWCCUUDFNC-QMMMGPOBSA-N
XLogP2.03
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (1S)-1-(2,4,6-trimethyl-3-pyridinyl)ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (1S)-1-(2,4,6-trimethyl-3-pyridinyl)ethanamine?
The IUPAC name of (1S)-1-(2,4,6-trimethyl-3-pyridinyl)ethanamine (CID 63750724) is (1S)-1-(2,4,6-trimethyl-3-pyridinyl)ethanamine.
What is the SMILES notation for (1S)-1-(2,4,6-trimethyl-3-pyridinyl)ethanamine?
The canonical SMILES for (1S)-1-(2,4,6-trimethyl-3-pyridinyl)ethanamine is Cc1cc(C)c([C@H](C)N)c(C)n1.
What is the InChIKey of (1S)-1-(2,4,6-trimethyl-3-pyridinyl)ethanamine?
The InChIKey is KJNAQWCCUUDFNC-QMMMGPOBSA-N. The full InChI is InChI=1S/C10H16N2/c1-6-5-7(2)12-9(4)10(6)8(3)11/h5,8H,11H2,1-4H3/t8-/m0/s1.
What are the key properties of (1S)-1-(2,4,6-trimethyl-3-pyridinyl)ethanamine?
(1S)-1-(2,4,6-trimethyl-3-pyridinyl)ethanamine has a molecular weight of 164.25 g/mol, XLogP of 2.03, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-(2,4,6-trimethyl-3-pyridinyl)ethanamine is sourced from PubChem (CID 63750724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).