1-(3-chloro-2-pyridinyl)-N-ethyl-2-(2-fluorophenyl)ethanamine

C15H16ClFN2 — CID 103444536

IUPAC1-(3-chloro-2-pyridinyl)-N-ethyl-2-(2-fluorophenyl)ethanamine
SMILESCCNC(Cc1ccccc1F)c1ncccc1Cl
InChIInChI=1S/C15H16ClFN2/c1-2-18-14(15-12(16)7-5-9-19-15)10-11-6-3-4-8-13(11)17/h3-9,14,18H,2,10H2,1H3
InChIKeyRYNIVBXUPVVJAY-UHFFFAOYSA-N
MW278.76 g/mol
LogP3.77
Rot. Bonds5

About 1-(3-chloro-2-pyridinyl)-N-ethyl-2-(2-fluorophenyl)ethanamine

1-(3-chloro-2-pyridinyl)-N-ethyl-2-(2-fluorophenyl)ethanamine (PubChem CID 103444536) has the molecular formula C15H16ClFN2 and a molecular weight of 278.76 g/mol. Its IUPAC name is 1-(3-chloro-2-pyridinyl)-N-ethyl-2-(2-fluorophenyl)ethanamine.

Molecular Properties

Compound Name1-(3-chloro-2-pyridinyl)-N-ethyl-2-(2-fluorophenyl)ethanamine
PubChem CID103444536
Molecular FormulaC15H16ClFN2
Molecular Weight278.76 g/mol
Exact Mass278.10
IUPAC Name1-(3-chloro-2-pyridinyl)-N-ethyl-2-(2-fluorophenyl)ethanamine
SMILESCCNC(Cc1ccccc1F)c1ncccc1Cl
InChIInChI=1S/C15H16ClFN2/c1-2-18-14(15-12(16)7-5-9-19-15)10-11-6-3-4-8-13(11)17/h3-9,14,18H,2,10H2,1H3
InChIKeyRYNIVBXUPVVJAY-UHFFFAOYSA-N
XLogP3.77
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.76
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(3-chloro-2-pyridinyl)-2-(2,3-difluorophenyl)ethyl]propan-1-amine
CID 103444893
1-(3-bromo-2-pyridinyl)-2-(5-chloro-2-fluorophenyl)-N-ethylethanamine
CID 103049088
2-(3-chloro-4-fluorophenyl)-N-ethyl-1-(3-fluoro-2-pyridinyl)ethanamine
CID 103040362
1-(3-chloro-2-pyridinyl)-2-(3-chlorothiophen-2-yl)-N-ethylethanamine
CID 112749578
1-(3-chloro-2-pyridinyl)-N-ethylpentan-1-amine
CID 103444452
1-(2-chloro-5-fluorophenyl)-N-ethyl-2-(2-fluorophenyl)ethanamine
CID 105394794
2-(5-bromo-2-fluorophenyl)-N-ethyl-1-(3-ethyl-2-pyridinyl)ethanamine
CID 82732649
3-[2-(2,6-difluorophenyl)-2-(ethylamino)ethyl]pyridin-2-amine
CID 79522491
N-[1-(3-chloro-2-pyridinyl)-2-(5-fluoro-2-methylphenyl)ethyl]propan-1-amine
CID 103444762
2-(5-bromo-2-fluorophenyl)-1-(3-chloro-2-pyridinyl)-N-methylethanamine
CID 103444324
1-(3-chloro-2-pyridinyl)-N-ethyl-2-(1-methylpyrazol-4-yl)ethanamine
CID 103444657
2-(3,4-dichlorophenyl)-N-ethyl-1-(3-ethyl-2-pyridinyl)ethanamine
CID 82732781

Frequently Asked Questions

What is the IUPAC name of 1-(3-chloro-2-pyridinyl)-N-ethyl-2-(2-fluorophenyl)ethanamine?
The IUPAC name of 1-(3-chloro-2-pyridinyl)-N-ethyl-2-(2-fluorophenyl)ethanamine (CID 103444536) is 1-(3-chloro-2-pyridinyl)-N-ethyl-2-(2-fluorophenyl)ethanamine.
What is the SMILES notation for 1-(3-chloro-2-pyridinyl)-N-ethyl-2-(2-fluorophenyl)ethanamine?
The canonical SMILES for 1-(3-chloro-2-pyridinyl)-N-ethyl-2-(2-fluorophenyl)ethanamine is CCNC(Cc1ccccc1F)c1ncccc1Cl.
What is the InChIKey of 1-(3-chloro-2-pyridinyl)-N-ethyl-2-(2-fluorophenyl)ethanamine?
The InChIKey is RYNIVBXUPVVJAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClFN2/c1-2-18-14(15-12(16)7-5-9-19-15)10-11-6-3-4-8-13(11)17/h3-9,14,18H,2,10H2,1H3.
What are the key properties of 1-(3-chloro-2-pyridinyl)-N-ethyl-2-(2-fluorophenyl)ethanamine?
1-(3-chloro-2-pyridinyl)-N-ethyl-2-(2-fluorophenyl)ethanamine has a molecular weight of 278.76 g/mol, XLogP of 3.77, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chloro-2-pyridinyl)-N-ethyl-2-(2-fluorophenyl)ethanamine is sourced from PubChem (CID 103444536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).