2-(3,6-dihydro-2H-pyridin-1-yl)-3-methoxy-N-methylpropan-1-amine

C10H20N2O — CID 103227322

IUPAC2-(3,6-dihydro-2H-pyridin-1-yl)-3-methoxy-N-methylpropan-1-amine
SMILESCNCC(COC)N1CC=CCC1
InChIInChI=1S/C10H20N2O/c1-11-8-10(9-13-2)12-6-4-3-5-7-12/h3-4,10-11H,5-9H2,1-2H3
InChIKeyFMVSOLMIHYVZNG-UHFFFAOYSA-N
MW184.28 g/mol
LogP0.48
Rot. Bonds5

About 2-(3,6-dihydro-2H-pyridin-1-yl)-3-methoxy-N-methylpropan-1-amine

2-(3,6-dihydro-2H-pyridin-1-yl)-3-methoxy-N-methylpropan-1-amine (PubChem CID 103227322) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 2-(3,6-dihydro-2H-pyridin-1-yl)-3-methoxy-N-methylpropan-1-amine.

Molecular Properties

Compound Name2-(3,6-dihydro-2H-pyridin-1-yl)-3-methoxy-N-methylpropan-1-amine
PubChem CID103227322
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name2-(3,6-dihydro-2H-pyridin-1-yl)-3-methoxy-N-methylpropan-1-amine
SMILESCNCC(COC)N1CC=CCC1
InChIInChI=1S/C10H20N2O/c1-11-8-10(9-13-2)12-6-4-3-5-7-12/h3-4,10-11H,5-9H2,1-2H3
InChIKeyFMVSOLMIHYVZNG-UHFFFAOYSA-N
XLogP0.48
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 2-(3,6-dihydro-2H-pyridin-1-yl)-3-methoxy-N-methylpropan-1-amine with MolForge

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

Launch Full Analysis

Related Compounds

N-[3-methoxy-2-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]propyl]-2-methylpropan-1-amine
CID 103227352
N-[3-methoxy-2-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]propyl]-2-methylpropan-2-amine
CID 103227353
N-ethyl-3-methoxy-2-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]propan-1-amine
CID 103227354
3-methoxy-N-propan-2-yl-2-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]propan-1-amine
CID 103227355
3-methoxy-N-propyl-2-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]propan-1-amine
CID 103227356
3-methoxy-2-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]propan-1-amine
CID 103227357
3-methoxy-N-methyl-2-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]propan-1-amine
CID 113790721
(Z)-N-(1-methoxybutan-2-yl)pent-3-en-1-amine
CID 88943258
(5-Methoxy-3-methyl-1,2,3,6-tetrahydropyridin-6-yl)methanamine
CID 90815987
(2S,4Z,6Z)-1-N-ethyl-1-N-(2-methoxyethyl)-2-N-methyl-3-methylideneocta-4,6-diene-1,2-diamine
CID 132122159
(3Z)-3-N-(1-methoxypropan-2-yl)-2-N,2-N,2-trimethylhexa-3,5-diene-2,3-diamine
CID 135181463
(Z)-2-N-methyl-1-N-(morpholin-3-ylmethyl)pent-2-ene-1,2-diamine
CID 135191469

Frequently Asked Questions

What is the IUPAC name of 2-(3,6-dihydro-2H-pyridin-1-yl)-3-methoxy-N-methylpropan-1-amine?
The IUPAC name of 2-(3,6-dihydro-2H-pyridin-1-yl)-3-methoxy-N-methylpropan-1-amine (CID 103227322) is 2-(3,6-dihydro-2H-pyridin-1-yl)-3-methoxy-N-methylpropan-1-amine.
What is the SMILES notation for 2-(3,6-dihydro-2H-pyridin-1-yl)-3-methoxy-N-methylpropan-1-amine?
The canonical SMILES for 2-(3,6-dihydro-2H-pyridin-1-yl)-3-methoxy-N-methylpropan-1-amine is CNCC(COC)N1CC=CCC1.
What is the InChIKey of 2-(3,6-dihydro-2H-pyridin-1-yl)-3-methoxy-N-methylpropan-1-amine?
The InChIKey is FMVSOLMIHYVZNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-11-8-10(9-13-2)12-6-4-3-5-7-12/h3-4,10-11H,5-9H2,1-2H3.
What are the key properties of 2-(3,6-dihydro-2H-pyridin-1-yl)-3-methoxy-N-methylpropan-1-amine?
2-(3,6-dihydro-2H-pyridin-1-yl)-3-methoxy-N-methylpropan-1-amine has a molecular weight of 184.28 g/mol, XLogP of 0.48, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,6-dihydro-2H-pyridin-1-yl)-3-methoxy-N-methylpropan-1-amine is sourced from PubChem (CID 103227322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).