2-(2-ethyl-3H-pyridin-2-yl)-N-methylethanamine

C10H18N2 — CID 143815612

IUPAC2-(2-ethyl-3H-pyridin-2-yl)-N-methylethanamine
SMILESCCC1(CCNC)CC=CC=N1
InChIInChI=1S/C10H18N2/c1-3-10(7-9-11-2)6-4-5-8-12-10/h4-5,8,11H,3,6-7,9H2,1-2H3
InChIKeyMBLRDODGVXBTRZ-UHFFFAOYSA-N
MW166.27 g/mol
LogP1.78
Rot. Bonds4

About 2-(2-ethyl-3H-pyridin-2-yl)-N-methylethanamine

2-(2-ethyl-3H-pyridin-2-yl)-N-methylethanamine (PubChem CID 143815612) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is 2-(2-ethyl-3H-pyridin-2-yl)-N-methylethanamine.

Molecular Properties

Compound Name2-(2-ethyl-3H-pyridin-2-yl)-N-methylethanamine
PubChem CID143815612
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC Name2-(2-ethyl-3H-pyridin-2-yl)-N-methylethanamine
SMILESCCC1(CCNC)CC=CC=N1
InChIInChI=1S/C10H18N2/c1-3-10(7-9-11-2)6-4-5-8-12-10/h4-5,8,11H,3,6-7,9H2,1-2H3
InChIKeyMBLRDODGVXBTRZ-UHFFFAOYSA-N
XLogP1.78
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-ethyl-3H-pyridin-2-yl)-N-methylethanamine?
The IUPAC name of 2-(2-ethyl-3H-pyridin-2-yl)-N-methylethanamine (CID 143815612) is 2-(2-ethyl-3H-pyridin-2-yl)-N-methylethanamine.
What is the SMILES notation for 2-(2-ethyl-3H-pyridin-2-yl)-N-methylethanamine?
The canonical SMILES for 2-(2-ethyl-3H-pyridin-2-yl)-N-methylethanamine is CCC1(CCNC)CC=CC=N1.
What is the InChIKey of 2-(2-ethyl-3H-pyridin-2-yl)-N-methylethanamine?
The InChIKey is MBLRDODGVXBTRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2/c1-3-10(7-9-11-2)6-4-5-8-12-10/h4-5,8,11H,3,6-7,9H2,1-2H3.
What are the key properties of 2-(2-ethyl-3H-pyridin-2-yl)-N-methylethanamine?
2-(2-ethyl-3H-pyridin-2-yl)-N-methylethanamine has a molecular weight of 166.27 g/mol, XLogP of 1.78, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethyl-3H-pyridin-2-yl)-N-methylethanamine is sourced from PubChem (CID 143815612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).