1-(2-chlorofuran-3-yl)-N-ethyl-2-pyridin-4-ylethanamine

C13H15ClN2O — CID 106688072

IUPAC1-(2-chlorofuran-3-yl)-N-ethyl-2-pyridin-4-ylethanamine
SMILESCCNC(Cc1ccncc1)c1ccoc1Cl
InChIInChI=1S/C13H15ClN2O/c1-2-16-12(11-5-8-17-13(11)14)9-10-3-6-15-7-4-10/h3-8,12,16H,2,9H2,1H3
InChIKeyHFTSZJGEFUYVKW-UHFFFAOYSA-N
MW250.73 g/mol
LogP3.22
Rot. Bonds5

About 1-(2-chlorofuran-3-yl)-N-ethyl-2-pyridin-4-ylethanamine

1-(2-chlorofuran-3-yl)-N-ethyl-2-pyridin-4-ylethanamine (PubChem CID 106688072) has the molecular formula C13H15ClN2O and a molecular weight of 250.73 g/mol. Its IUPAC name is 1-(2-chlorofuran-3-yl)-N-ethyl-2-pyridin-4-ylethanamine.

Molecular Properties

Compound Name1-(2-chlorofuran-3-yl)-N-ethyl-2-pyridin-4-ylethanamine
PubChem CID106688072
Molecular FormulaC13H15ClN2O
Molecular Weight250.73 g/mol
Exact Mass250.09
IUPAC Name1-(2-chlorofuran-3-yl)-N-ethyl-2-pyridin-4-ylethanamine
SMILESCCNC(Cc1ccncc1)c1ccoc1Cl
InChIInChI=1S/C13H15ClN2O/c1-2-16-12(11-5-8-17-13(11)14)9-10-3-6-15-7-4-10/h3-8,12,16H,2,9H2,1H3
InChIKeyHFTSZJGEFUYVKW-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

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Related Compounds

1-(2-chloro-3-fluorophenyl)-N-ethyl-2-pyridin-4-ylethanamine
CID 81454386
4-[2-bromo-2-(2-chlorofuran-3-yl)ethyl]pyridine
CID 106690746
1-(2-chlorofuran-3-yl)-N-ethyl-2-quinolin-2-ylethanamine
CID 106688064
1-(2-chlorofuran-3-yl)-N-ethyl-2-(4-methyl-1,3-thiazol-2-yl)ethanamine
CID 106692760
1-(2-chlorofuran-3-yl)-2-(2,5-dimethylpyrazol-3-yl)-N-ethylethanamine
CID 106692336
[1-(2-chlorofuran-3-yl)-2-phenylethyl]hydrazine
CID 106694144
N-[1-(2-chlorofuran-3-yl)-2-(3-chlorophenyl)ethyl]propan-1-amine
CID 106687887
N-[1-(2-chlorofuran-3-yl)-2-(3,4-difluorophenyl)ethyl]propan-1-amine
CID 106687928
N-[1-(2,5-dichlorophenyl)-2-pyridin-4-ylethyl]propan-1-amine
CID 62791433
1-(2-chlorophenyl)-2-(4-chlorophenyl)-N-ethylethanamine
CID 63412910
N-[(2-chlorofuran-3-yl)-(1-ethylimidazol-2-yl)methyl]ethanamine
CID 106689411
2-(3-chlorophenyl)-N-ethyl-1-(2-methylfuran-3-yl)ethanamine
CID 62503419

Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorofuran-3-yl)-N-ethyl-2-pyridin-4-ylethanamine?
The IUPAC name of 1-(2-chlorofuran-3-yl)-N-ethyl-2-pyridin-4-ylethanamine (CID 106688072) is 1-(2-chlorofuran-3-yl)-N-ethyl-2-pyridin-4-ylethanamine.
What is the SMILES notation for 1-(2-chlorofuran-3-yl)-N-ethyl-2-pyridin-4-ylethanamine?
The canonical SMILES for 1-(2-chlorofuran-3-yl)-N-ethyl-2-pyridin-4-ylethanamine is CCNC(Cc1ccncc1)c1ccoc1Cl.
What is the InChIKey of 1-(2-chlorofuran-3-yl)-N-ethyl-2-pyridin-4-ylethanamine?
The InChIKey is HFTSZJGEFUYVKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15ClN2O/c1-2-16-12(11-5-8-17-13(11)14)9-10-3-6-15-7-4-10/h3-8,12,16H,2,9H2,1H3.
What are the key properties of 1-(2-chlorofuran-3-yl)-N-ethyl-2-pyridin-4-ylethanamine?
1-(2-chlorofuran-3-yl)-N-ethyl-2-pyridin-4-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-(2-chlorofuran-3-yl)-N-ethyl-2-pyridin-4-ylethanamine is sourced from PubChem (CID 106688072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).