4-ethoxy-1-ethyl-3,4-dihydro-2H-pyridine

C9H17NO — CID 143417435

IUPAC4-ethoxy-1-ethyl-3,4-dihydro-2H-pyridine
SMILESCCOC1C=CN(CC)CC1
InChIInChI=1S/C9H17NO/c1-3-10-7-5-9(6-8-10)11-4-2/h5,7,9H,3-4,6,8H2,1-2H3
InChIKeyVZRMORFHLBNNCM-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.63
Rot. Bonds3

About 4-ethoxy-1-ethyl-3,4-dihydro-2H-pyridine

4-ethoxy-1-ethyl-3,4-dihydro-2H-pyridine (PubChem CID 143417435) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is 4-ethoxy-1-ethyl-3,4-dihydro-2H-pyridine.

Molecular Properties

Compound Name4-ethoxy-1-ethyl-3,4-dihydro-2H-pyridine
PubChem CID143417435
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name4-ethoxy-1-ethyl-3,4-dihydro-2H-pyridine
SMILESCCOC1C=CN(CC)CC1
InChIInChI=1S/C9H17NO/c1-3-10-7-5-9(6-8-10)11-4-2/h5,7,9H,3-4,6,8H2,1-2H3
InChIKeyVZRMORFHLBNNCM-UHFFFAOYSA-N
XLogP1.63
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-but-3-en-2-yloxypropyl)-N-(3-fluoropropyl)butan-1-amine
CID 166686147
3-[5-(dimethylamino)pent-1-en-3-yloxy]-N,N-dimethylpent-4-en-1-amine
CID 87605996
(3S)-3-methoxy-N,N-dimethylpent-4-en-1-amine
CID 156242999
4-Ethoxy-1,4-dimethyl-2,3-dihydropyridine
CID 169895367
(1E)-3-methoxy-N,N-dimethylhexa-1,5-dien-1-amine
CID 10749413
4-ethoxy-1-methyl-3,4-dihydro-2H-pyridine
CID 45087869
(4R)-4-ethoxy-1-methyl-3,4-dihydro-2H-pyridine
CID 98078667
(4S)-4-ethoxy-1-methyl-3,4-dihydro-2H-pyridine
CID 98078668
(E)-3-butoxy-N,N-dimethylbut-1-en-1-amine
CID 144344602

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-1-ethyl-3,4-dihydro-2H-pyridine?
The IUPAC name of 4-ethoxy-1-ethyl-3,4-dihydro-2H-pyridine (CID 143417435) is 4-ethoxy-1-ethyl-3,4-dihydro-2H-pyridine.
What is the SMILES notation for 4-ethoxy-1-ethyl-3,4-dihydro-2H-pyridine?
The canonical SMILES for 4-ethoxy-1-ethyl-3,4-dihydro-2H-pyridine is CCOC1C=CN(CC)CC1.
What is the InChIKey of 4-ethoxy-1-ethyl-3,4-dihydro-2H-pyridine?
The InChIKey is VZRMORFHLBNNCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-3-10-7-5-9(6-8-10)11-4-2/h5,7,9H,3-4,6,8H2,1-2H3.
What are the key properties of 4-ethoxy-1-ethyl-3,4-dihydro-2H-pyridine?
4-ethoxy-1-ethyl-3,4-dihydro-2H-pyridine has a molecular weight of 155.24 g/mol, XLogP of 1.63, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-1-ethyl-3,4-dihydro-2H-pyridine is sourced from PubChem (CID 143417435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).