5-chloro-N-ethyl-6-[(2-fluoro-5-methylphenoxy)methyl]pyridin-2-amine

C15H16ClFN2O — CID 64854294

IUPAC5-chloro-N-ethyl-6-[(2-fluoro-5-methylphenoxy)methyl]pyridin-2-amine
SMILESCCNc1ccc(Cl)c(COc2cc(C)ccc2F)n1
InChIInChI=1S/C15H16ClFN2O/c1-3-18-15-7-5-11(16)13(19-15)9-20-14-8-10(2)4-6-12(14)17/h4-8H,3,9H2,1-2H3,(H,18,19)
InChIKeyHNWMIAFKUHGDFM-UHFFFAOYSA-N
MW294.76 g/mol
LogP4.19
Rot. Bonds5

About 5-chloro-N-ethyl-6-[(2-fluoro-5-methylphenoxy)methyl]pyridin-2-amine

5-chloro-N-ethyl-6-[(2-fluoro-5-methylphenoxy)methyl]pyridin-2-amine (PubChem CID 64854294) has the molecular formula C15H16ClFN2O and a molecular weight of 294.76 g/mol. Its IUPAC name is 5-chloro-N-ethyl-6-[(2-fluoro-5-methylphenoxy)methyl]pyridin-2-amine.

Molecular Properties

Compound Name5-chloro-N-ethyl-6-[(2-fluoro-5-methylphenoxy)methyl]pyridin-2-amine
PubChem CID64854294
Molecular FormulaC15H16ClFN2O
Molecular Weight294.76 g/mol
Exact Mass294.09
IUPAC Name5-chloro-N-ethyl-6-[(2-fluoro-5-methylphenoxy)methyl]pyridin-2-amine
SMILESCCNc1ccc(Cl)c(COc2cc(C)ccc2F)n1
InChIInChI=1S/C15H16ClFN2O/c1-3-18-15-7-5-11(16)13(19-15)9-20-14-8-10(2)4-6-12(14)17/h4-8H,3,9H2,1-2H3,(H,18,19)
InChIKeyHNWMIAFKUHGDFM-UHFFFAOYSA-N
XLogP4.19
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.76
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-{[3-({[2-(3-Fluorophenyl)ethyl]amino}methyl)phenoxy]methyl}-4-Methylpyridin-2-Amine
CID 71627413
(S)-8-(2-chlorophenoxy)-2-(piperazin-1-yl)-5,6,7,8-tetrahydroquinoline
CID 46228437
2-N-benzyl-4-N-[3-(4-chlorophenoxy)propyl]-6-methylpyrimidine-2,4-diamine;hydrochloride
CID 44531381
(R)-8-(2-chlorophenoxy)-2-(piperazin-1-yl)-5,6,7,8-tetrahydroquinoline
CID 46228430
2-(4-chlorophenoxy)-N-(4,6-dimethylpyridin-2-yl)acetamide
CID 295299
2-[3-[(2-Chloro-6-fluorophenyl)methoxy]-2-pyridinyl]-1-(4-methylphenyl)guanidine
CID 44533043
N-[(1S)-1-[4-[1-[5-chloro-6-(trifluoromethyl)pyridin-2-yl]azetidin-3-yl]oxyphenyl]ethyl]acetamide
CID 89643416
N-[(1S)-1-[4-[(3R)-1-[5-chloro-6-(trifluoromethyl)pyridin-2-yl]pyrrolidin-3-yl]oxyphenyl]ethyl]acetamide
CID 91668889
6-({(3r,4r)-4-[4-(3-Chloro-5-Fluorophenoxy)butoxy]pyrrolidin-3-Yl}methyl)-4-Methylpyridin-2-Amine
CID 57345908
2-N-(2-phenoxyethyl)-6-N-[(1S)-1-phenylethyl]pyridine-2,6-diamine
CID 44393057
6-[[5-[2-(Dimethylamino)ethyl]-2,3-difluorophenoxy]methyl]-4-methylpyridin-2-amine
CID 176515336
6-[[2,3-Difluoro-5-[2-(methylamino)ethyl]phenoxy]methyl]-4-methylpyridin-2-amine
CID 176515337

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-ethyl-6-[(2-fluoro-5-methylphenoxy)methyl]pyridin-2-amine?
The IUPAC name of 5-chloro-N-ethyl-6-[(2-fluoro-5-methylphenoxy)methyl]pyridin-2-amine (CID 64854294) is 5-chloro-N-ethyl-6-[(2-fluoro-5-methylphenoxy)methyl]pyridin-2-amine.
What is the SMILES notation for 5-chloro-N-ethyl-6-[(2-fluoro-5-methylphenoxy)methyl]pyridin-2-amine?
The canonical SMILES for 5-chloro-N-ethyl-6-[(2-fluoro-5-methylphenoxy)methyl]pyridin-2-amine is CCNc1ccc(Cl)c(COc2cc(C)ccc2F)n1.
What is the InChIKey of 5-chloro-N-ethyl-6-[(2-fluoro-5-methylphenoxy)methyl]pyridin-2-amine?
The InChIKey is HNWMIAFKUHGDFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClFN2O/c1-3-18-15-7-5-11(16)13(19-15)9-20-14-8-10(2)4-6-12(14)17/h4-8H,3,9H2,1-2H3,(H,18,19).
What are the key properties of 5-chloro-N-ethyl-6-[(2-fluoro-5-methylphenoxy)methyl]pyridin-2-amine?
5-chloro-N-ethyl-6-[(2-fluoro-5-methylphenoxy)methyl]pyridin-2-amine has a molecular weight of 294.76 g/mol, XLogP of 4.19, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-ethyl-6-[(2-fluoro-5-methylphenoxy)methyl]pyridin-2-amine is sourced from PubChem (CID 64854294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).