N-[(2-chloro-6-methoxyphenyl)methyl]-4-methylpyridin-3-amine

C14H15ClN2O — CID 113434216

IUPACN-[(2-chloro-6-methoxyphenyl)methyl]-4-methylpyridin-3-amine
SMILESCOc1cccc(Cl)c1CNc1cnccc1C
InChIInChI=1S/C14H15ClN2O/c1-10-6-7-16-9-13(10)17-8-11-12(15)4-3-5-14(11)18-2/h3-7,9,17H,8H2,1-2H3
InChIKeyBQIRRRCJMLSDCA-UHFFFAOYSA-N
MW262.74 g/mol
LogP3.66
Rot. Bonds4

About N-[(2-chloro-6-methoxyphenyl)methyl]-4-methylpyridin-3-amine

N-[(2-chloro-6-methoxyphenyl)methyl]-4-methylpyridin-3-amine (PubChem CID 113434216) has the molecular formula C14H15ClN2O and a molecular weight of 262.74 g/mol. Its IUPAC name is N-[(2-chloro-6-methoxyphenyl)methyl]-4-methylpyridin-3-amine.

Molecular Properties

Compound NameN-[(2-chloro-6-methoxyphenyl)methyl]-4-methylpyridin-3-amine
PubChem CID113434216
Molecular FormulaC14H15ClN2O
Molecular Weight262.74 g/mol
Exact Mass262.09
IUPAC NameN-[(2-chloro-6-methoxyphenyl)methyl]-4-methylpyridin-3-amine
SMILESCOc1cccc(Cl)c1CNc1cnccc1C
InChIInChI=1S/C14H15ClN2O/c1-10-6-7-16-9-13(10)17-8-11-12(15)4-3-5-14(11)18-2/h3-7,9,17H,8H2,1-2H3
InChIKeyBQIRRRCJMLSDCA-UHFFFAOYSA-N
XLogP3.66
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.74
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2-chloro-6-methoxyphenyl)methyl]isoquinolin-5-amine
CID 115742878
3-N-[(2-chloro-6-methoxyphenyl)methyl]-4-methylbenzene-1,3-diamine
CID 103291779
N-[(2,3-dichlorophenyl)methyl]-4-methylpyridin-3-amine
CID 63329830
N-[(2-chloro-6-methoxyphenyl)methyl]-4-fluoro-2-methylaniline
CID 104815682
N-[(2-chloro-6-methoxyphenyl)methyl]-3-methylpyridin-2-amine
CID 104624373
N-[(2-chloro-6-methoxyphenyl)methyl]-1,3-dimethylpyrazol-4-amine
CID 104954500
2-bromo-3-chloro-N-[(2-chloro-6-methoxyphenyl)methyl]aniline
CID 103478606
N-[(2-chloro-6-methoxyphenyl)methyl]-3-methylpyrazin-2-amine
CID 103292832
3-bromo-N-[(2-chloro-6-methoxyphenyl)methyl]-2-methylaniline
CID 107630358
4-N-[(2-chloro-6-methoxyphenyl)methyl]-5-methylpyrimidine-2,4-diamine
CID 103293639
N-[(2-chloro-6-methoxyphenyl)methyl]-4-(methylamino)pyridine-3-carboxamide
CID 103293346
N-[(2-chloro-6-methoxyphenyl)methyl]-2,4-difluoroaniline
CID 104815678

Frequently Asked Questions

What is the IUPAC name of N-[(2-chloro-6-methoxyphenyl)methyl]-4-methylpyridin-3-amine?
The IUPAC name of N-[(2-chloro-6-methoxyphenyl)methyl]-4-methylpyridin-3-amine (CID 113434216) is N-[(2-chloro-6-methoxyphenyl)methyl]-4-methylpyridin-3-amine.
What is the SMILES notation for N-[(2-chloro-6-methoxyphenyl)methyl]-4-methylpyridin-3-amine?
The canonical SMILES for N-[(2-chloro-6-methoxyphenyl)methyl]-4-methylpyridin-3-amine is COc1cccc(Cl)c1CNc1cnccc1C.
What is the InChIKey of N-[(2-chloro-6-methoxyphenyl)methyl]-4-methylpyridin-3-amine?
The InChIKey is BQIRRRCJMLSDCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2O/c1-10-6-7-16-9-13(10)17-8-11-12(15)4-3-5-14(11)18-2/h3-7,9,17H,8H2,1-2H3.
What are the key properties of N-[(2-chloro-6-methoxyphenyl)methyl]-4-methylpyridin-3-amine?
N-[(2-chloro-6-methoxyphenyl)methyl]-4-methylpyridin-3-amine has a molecular weight of 262.74 g/mol, XLogP of 3.66, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-chloro-6-methoxyphenyl)methyl]-4-methylpyridin-3-amine is sourced from PubChem (CID 113434216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).