2-chloro-N-(3-ethylphenyl)-6-methylpyridin-3-amine

C14H15ClN2 — CID 139400879

IUPAC2-chloro-N-(3-ethylphenyl)-6-methylpyridin-3-amine
SMILESCCc1cccc(Nc2ccc(C)nc2Cl)c1
InChIInChI=1S/C14H15ClN2/c1-3-11-5-4-6-12(9-11)17-13-8-7-10(2)16-14(13)15/h4-9,17H,3H2,1-2H3
InChIKeyZFMORPMBMUPGCB-UHFFFAOYSA-N
MW246.74 g/mol
LogP4.35
Rot. Bonds3

About 2-chloro-N-(3-ethylphenyl)-6-methylpyridin-3-amine

2-chloro-N-(3-ethylphenyl)-6-methylpyridin-3-amine (PubChem CID 139400879) has the molecular formula C14H15ClN2 and a molecular weight of 246.74 g/mol. Its IUPAC name is 2-chloro-N-(3-ethylphenyl)-6-methylpyridin-3-amine.

Molecular Properties

Compound Name2-chloro-N-(3-ethylphenyl)-6-methylpyridin-3-amine
PubChem CID139400879
Molecular FormulaC14H15ClN2
Molecular Weight246.74 g/mol
Exact Mass246.09
IUPAC Name2-chloro-N-(3-ethylphenyl)-6-methylpyridin-3-amine
SMILESCCc1cccc(Nc2ccc(C)nc2Cl)c1
InChIInChI=1S/C14H15ClN2/c1-3-11-5-4-6-12(9-11)17-13-8-7-10(2)16-14(13)15/h4-9,17H,3H2,1-2H3
InChIKeyZFMORPMBMUPGCB-UHFFFAOYSA-N
XLogP4.35
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.74
LogP ≤ 54.35
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

4-chloro-N-(3-ethylphenyl)-6-methylpyrimidin-2-amine
CID 58910370
6-chloro-N-(3-ethylphenyl)-4,5-dimethylpyridazin-3-amine
CID 63549060
1-N-(3-ethylphenyl)-2-methylbenzene-1,4-diamine
CID 43165595
3-ethyl-N-[(6-methyl-2-pyridinyl)methyl]aniline
CID 79268214
6-chloro-N-(3-ethylphenyl)-5-methyl-2-propan-2-ylpyrimidin-4-amine
CID 80971019
3-ethyl-N-(4-methylphenyl)aniline
CID 139833776
2-chloro-N-[3-[[3-(2-fluorophenyl)-5-methyl-4,6-dihydropyrrolo[3,4-c]pyrazol-2-yl]methyl]phenyl]-6-methylpyridin-3-amine
CID 155591402
6-chloro-2-N-(3-ethylphenyl)pyridine-2,3-diamine
CID 113316737
6-N-(3-ethylphenyl)isoquinoline-5,6-diamine
CID 106947586
2-chloro-N-(3-ethylphenyl)-5-fluoropyrimidin-4-amine
CID 79080610
6-chloro-3-(3,5-dimethylpyrazol-1-yl)-N-(3-ethylphenyl)quinoxalin-2-amine
CID 22432192
2,6-diethyl-N-(3-ethylphenyl)aniline
CID 139833761

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(3-ethylphenyl)-6-methylpyridin-3-amine?
The IUPAC name of 2-chloro-N-(3-ethylphenyl)-6-methylpyridin-3-amine (CID 139400879) is 2-chloro-N-(3-ethylphenyl)-6-methylpyridin-3-amine.
What is the SMILES notation for 2-chloro-N-(3-ethylphenyl)-6-methylpyridin-3-amine?
The canonical SMILES for 2-chloro-N-(3-ethylphenyl)-6-methylpyridin-3-amine is CCc1cccc(Nc2ccc(C)nc2Cl)c1.
What is the InChIKey of 2-chloro-N-(3-ethylphenyl)-6-methylpyridin-3-amine?
The InChIKey is ZFMORPMBMUPGCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2/c1-3-11-5-4-6-12(9-11)17-13-8-7-10(2)16-14(13)15/h4-9,17H,3H2,1-2H3.
What are the key properties of 2-chloro-N-(3-ethylphenyl)-6-methylpyridin-3-amine?
2-chloro-N-(3-ethylphenyl)-6-methylpyridin-3-amine has a molecular weight of 246.74 g/mol, XLogP of 4.35, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(3-ethylphenyl)-6-methylpyridin-3-amine is sourced from PubChem (CID 139400879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).