2-chloro-N-[1-(4-fluorophenyl)ethyl]-4-methylpyridin-3-amine

C14H14ClFN2 — CID 65482956

IUPAC2-chloro-N-[1-(4-fluorophenyl)ethyl]-4-methylpyridin-3-amine
SMILESCc1ccnc(Cl)c1NC(C)c1ccc(F)cc1
InChIInChI=1S/C14H14ClFN2/c1-9-7-8-17-14(15)13(9)18-10(2)11-3-5-12(16)6-4-11/h3-8,10,18H,1-2H3
InChIKeyWXXBTKVLCNEFER-UHFFFAOYSA-N
MW264.73 g/mol
LogP4.36
Rot. Bonds3

About 2-chloro-N-[1-(4-fluorophenyl)ethyl]-4-methylpyridin-3-amine

2-chloro-N-[1-(4-fluorophenyl)ethyl]-4-methylpyridin-3-amine (PubChem CID 65482956) has the molecular formula C14H14ClFN2 and a molecular weight of 264.73 g/mol. Its IUPAC name is 2-chloro-N-[1-(4-fluorophenyl)ethyl]-4-methylpyridin-3-amine.

Molecular Properties

Compound Name2-chloro-N-[1-(4-fluorophenyl)ethyl]-4-methylpyridin-3-amine
PubChem CID65482956
Molecular FormulaC14H14ClFN2
Molecular Weight264.73 g/mol
Exact Mass264.08
IUPAC Name2-chloro-N-[1-(4-fluorophenyl)ethyl]-4-methylpyridin-3-amine
SMILESCc1ccnc(Cl)c1NC(C)c1ccc(F)cc1
InChIInChI=1S/C14H14ClFN2/c1-9-7-8-17-14(15)13(9)18-10(2)11-3-5-12(16)6-4-11/h3-8,10,18H,1-2H3
InChIKeyWXXBTKVLCNEFER-UHFFFAOYSA-N
XLogP4.36
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.73
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2-chloro-4-methyl-N-[1-(4-methylsulfanylphenyl)ethyl]pyridin-3-amine
CID 65484915
2-chloro-N-[1-(4-methoxyphenyl)ethyl]-4-methylpyridin-3-amine
CID 65483339
4-[1-[(2-chloro-4-methyl-3-pyridinyl)amino]ethyl]benzonitrile
CID 65482779
2-chloro-N-[cyclopropyl-(4-fluorophenyl)methyl]-4-methylpyridin-3-amine
CID 65483337
2-chloro-N-[1-(4-fluorophenyl)propan-2-yl]-4-methylpyridin-3-amine
CID 114830017
5-[1-[(2-chloro-4-methyl-3-pyridinyl)amino]ethyl]-1,3-dihydrobenzimidazol-2-one
CID 65483753
2-chloro-N-[1-(3-methoxyphenyl)ethyl]-4-methylpyridin-3-amine
CID 65483939
N-[1-(4-fluorophenyl)ethyl]-2,4,6-trimethylaniline
CID 63448200
N-[1-(4-fluorophenyl)ethyl]-4-methylpyrimidin-2-amine
CID 62960002
2-chloro-N-[1-(3-fluorophenyl)propyl]-4-methylpyridin-3-amine
CID 114871652
2-chloro-N-[1-(2,5-dimethylthiophen-3-yl)ethyl]-4-methylpyridin-3-amine
CID 65484697
2-N-[1-(4-fluorophenyl)ethyl]-3-methylbenzene-1,2-diamine
CID 115550261

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[1-(4-fluorophenyl)ethyl]-4-methylpyridin-3-amine?
The IUPAC name of 2-chloro-N-[1-(4-fluorophenyl)ethyl]-4-methylpyridin-3-amine (CID 65482956) is 2-chloro-N-[1-(4-fluorophenyl)ethyl]-4-methylpyridin-3-amine.
What is the SMILES notation for 2-chloro-N-[1-(4-fluorophenyl)ethyl]-4-methylpyridin-3-amine?
The canonical SMILES for 2-chloro-N-[1-(4-fluorophenyl)ethyl]-4-methylpyridin-3-amine is Cc1ccnc(Cl)c1NC(C)c1ccc(F)cc1.
What is the InChIKey of 2-chloro-N-[1-(4-fluorophenyl)ethyl]-4-methylpyridin-3-amine?
The InChIKey is WXXBTKVLCNEFER-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClFN2/c1-9-7-8-17-14(15)13(9)18-10(2)11-3-5-12(16)6-4-11/h3-8,10,18H,1-2H3.
What are the key properties of 2-chloro-N-[1-(4-fluorophenyl)ethyl]-4-methylpyridin-3-amine?
2-chloro-N-[1-(4-fluorophenyl)ethyl]-4-methylpyridin-3-amine has a molecular weight of 264.73 g/mol, XLogP of 4.36, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[1-(4-fluorophenyl)ethyl]-4-methylpyridin-3-amine is sourced from PubChem (CID 65482956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).