2-(3,4-dihydropyridin-6-yl)-N-methylethanamine

C8H14N2 — CID 144767451

IUPAC2-(3,4-dihydropyridin-6-yl)-N-methylethanamine
SMILESCNCCC1=CCCC=N1
InChIInChI=1S/C8H14N2/c1-9-7-5-8-4-2-3-6-10-8/h4,6,9H,2-3,5,7H2,1H3
InChIKeyVXTKTBZDSUFPJO-UHFFFAOYSA-N
MW138.21 g/mol
LogP1.34
Rot. Bonds3

About 2-(3,4-dihydropyridin-6-yl)-N-methylethanamine

2-(3,4-dihydropyridin-6-yl)-N-methylethanamine (PubChem CID 144767451) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is 2-(3,4-dihydropyridin-6-yl)-N-methylethanamine.

Molecular Properties

Compound Name2-(3,4-dihydropyridin-6-yl)-N-methylethanamine
PubChem CID144767451
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC Name2-(3,4-dihydropyridin-6-yl)-N-methylethanamine
SMILESCNCCC1=CCCC=N1
InChIInChI=1S/C8H14N2/c1-9-7-5-8-4-2-3-6-10-8/h4,6,9H,2-3,5,7H2,1H3
InChIKeyVXTKTBZDSUFPJO-UHFFFAOYSA-N
XLogP1.34
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3,4-Dihydropyridin-6-yl)propan-1-amine
CID 53823373
N-methyl-2-(3H-pyrrol-5-yl)ethanamine
CID 58164545
2-(3,4-dihydropyridin-6-yl)-N,N-dimethylethanamine
CID 70372271
(Z)-N-methyl-1-methyliminohex-2-en-3-amine
CID 88953346
N-(3,4-dihydropyridin-6-ylmethyl)propan-2-amine
CID 89002162
(Z)-3-(ethylideneamino)pent-3-en-1-amine
CID 89028862
N-[2-(3H-pyrrol-5-yl)ethyl]propan-2-amine
CID 89849276
N-methyl-2-(3-methyl-3,4-dihydropyridin-6-yl)ethanamine
CID 91433495
N-propan-2-yl-3-(3H-pyrrol-5-yl)propan-1-amine
CID 117754027
2-[(E)-but-2-en-2-yl]-5-methyl-1,2-dihydropyrazine
CID 132149671
N-(1-prop-1-en-2-yliminobutan-2-yl)cyclohex-3-en-1-amine
CID 138549377
(Z)-N-methyl-4-(prop-2-enylideneamino)hex-4-en-2-amine
CID 141785733

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dihydropyridin-6-yl)-N-methylethanamine?
The IUPAC name of 2-(3,4-dihydropyridin-6-yl)-N-methylethanamine (CID 144767451) is 2-(3,4-dihydropyridin-6-yl)-N-methylethanamine.
What is the SMILES notation for 2-(3,4-dihydropyridin-6-yl)-N-methylethanamine?
The canonical SMILES for 2-(3,4-dihydropyridin-6-yl)-N-methylethanamine is CNCCC1=CCCC=N1.
What is the InChIKey of 2-(3,4-dihydropyridin-6-yl)-N-methylethanamine?
The InChIKey is VXTKTBZDSUFPJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2/c1-9-7-5-8-4-2-3-6-10-8/h4,6,9H,2-3,5,7H2,1H3.
What are the key properties of 2-(3,4-dihydropyridin-6-yl)-N-methylethanamine?
2-(3,4-dihydropyridin-6-yl)-N-methylethanamine has a molecular weight of 138.21 g/mol, XLogP of 1.34, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dihydropyridin-6-yl)-N-methylethanamine is sourced from PubChem (CID 144767451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).