1-(5-chlorofuran-2-yl)-N-ethyl-2-pyridin-3-ylethanamine

C13H15ClN2O — CID 106693011

IUPAC1-(5-chlorofuran-2-yl)-N-ethyl-2-pyridin-3-ylethanamine
SMILESCCNC(Cc1cccnc1)c1ccc(Cl)o1
InChIInChI=1S/C13H15ClN2O/c1-2-16-11(12-5-6-13(14)17-12)8-10-4-3-7-15-9-10/h3-7,9,11,16H,2,8H2,1H3
InChIKeyAAHBXMUCRFXMEY-UHFFFAOYSA-N
MW250.73 g/mol
LogP3.22
Rot. Bonds5

About 1-(5-chlorofuran-2-yl)-N-ethyl-2-pyridin-3-ylethanamine

1-(5-chlorofuran-2-yl)-N-ethyl-2-pyridin-3-ylethanamine (PubChem CID 106693011) has the molecular formula C13H15ClN2O and a molecular weight of 250.73 g/mol. Its IUPAC name is 1-(5-chlorofuran-2-yl)-N-ethyl-2-pyridin-3-ylethanamine.

Molecular Properties

Compound Name1-(5-chlorofuran-2-yl)-N-ethyl-2-pyridin-3-ylethanamine
PubChem CID106693011
Molecular FormulaC13H15ClN2O
Molecular Weight250.73 g/mol
Exact Mass250.09
IUPAC Name1-(5-chlorofuran-2-yl)-N-ethyl-2-pyridin-3-ylethanamine
SMILESCCNC(Cc1cccnc1)c1ccc(Cl)o1
InChIInChI=1S/C13H15ClN2O/c1-2-16-11(12-5-6-13(14)17-12)8-10-4-3-7-15-9-10/h3-7,9,11,16H,2,8H2,1H3
InChIKeyAAHBXMUCRFXMEY-UHFFFAOYSA-N
XLogP3.22
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.73
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(5-chlorofuran-2-yl)-N-ethyl-2-pyridin-3-ylethanamine 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

1-(2,6-dichlorophenyl)-N-ethyl-2-pyridin-3-ylethanamine
CID 105034466
1-(5-chlorofuran-2-yl)-N-ethylpropan-1-amine
CID 106691408
1-(2,3-dichlorophenyl)-N-ethyl-2-pyridin-3-ylethanamine
CID 62791096
N-ethyl-1-(4-methylphenyl)-2-pyridin-3-ylethanamine
CID 62551907
1-(5-bromo-2-pyridinyl)-N-ethyl-2-pyridin-3-ylethanamine
CID 104736768
1-(3-bromo-5-chlorophenyl)-N-ethyl-2-pyridin-3-ylethanamine
CID 107946692
1-(5-ethylfuran-2-yl)-N-methyl-2-pyridin-3-ylethanamine
CID 105034717
1-(5-chlorofuran-2-yl)-2-(3,4-difluorophenyl)-N-ethylethanamine
CID 106687925
N-ethyl-1-(2-ethylphenyl)-2-pyridin-3-ylethanamine
CID 105034649
1-(4-chlorophenyl)-N-ethyl-3-pyridin-3-ylpropan-2-amine
CID 62551023
1-(5-chlorofuran-2-yl)-N-ethyl-2-thiophen-2-ylethanamine
CID 106687804
N-ethyl-1-[3-(2-methylpropyl)phenyl]-2-pyridin-3-ylethanamine
CID 116544214

Frequently Asked Questions

What is the IUPAC name of 1-(5-chlorofuran-2-yl)-N-ethyl-2-pyridin-3-ylethanamine?
The IUPAC name of 1-(5-chlorofuran-2-yl)-N-ethyl-2-pyridin-3-ylethanamine (CID 106693011) is 1-(5-chlorofuran-2-yl)-N-ethyl-2-pyridin-3-ylethanamine.
What is the SMILES notation for 1-(5-chlorofuran-2-yl)-N-ethyl-2-pyridin-3-ylethanamine?
The canonical SMILES for 1-(5-chlorofuran-2-yl)-N-ethyl-2-pyridin-3-ylethanamine is CCNC(Cc1cccnc1)c1ccc(Cl)o1.
What is the InChIKey of 1-(5-chlorofuran-2-yl)-N-ethyl-2-pyridin-3-ylethanamine?
The InChIKey is AAHBXMUCRFXMEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15ClN2O/c1-2-16-11(12-5-6-13(14)17-12)8-10-4-3-7-15-9-10/h3-7,9,11,16H,2,8H2,1H3.
What are the key properties of 1-(5-chlorofuran-2-yl)-N-ethyl-2-pyridin-3-ylethanamine?
1-(5-chlorofuran-2-yl)-N-ethyl-2-pyridin-3-ylethanamine has a molecular weight of 250.73 g/mol, XLogP of 3.22, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-chlorofuran-2-yl)-N-ethyl-2-pyridin-3-ylethanamine is sourced from PubChem (CID 106693011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).