[2-chloro-6-[methyl(pyridin-4-ylmethyl)amino]phenyl]methanol

C14H15ClN2O — CID 43564416

IUPAC[2-chloro-6-[methyl(pyridin-4-ylmethyl)amino]phenyl]methanol
SMILESCN(Cc1ccncc1)c1cccc(Cl)c1CO
InChIInChI=1S/C14H15ClN2O/c1-17(9-11-5-7-16-8-6-11)14-4-2-3-13(15)12(14)10-18/h2-8,18H,9-10H2,1H3
InChIKeyOUXVPLIXXQEGTO-UHFFFAOYSA-N
MW262.74 g/mol
LogP2.86
Rot. Bonds4

About [2-chloro-6-[methyl(pyridin-4-ylmethyl)amino]phenyl]methanol

[2-chloro-6-[methyl(pyridin-4-ylmethyl)amino]phenyl]methanol (PubChem CID 43564416) has the molecular formula C14H15ClN2O and a molecular weight of 262.74 g/mol. Its IUPAC name is [2-chloro-6-[methyl(pyridin-4-ylmethyl)amino]phenyl]methanol.

Molecular Properties

Compound Name[2-chloro-6-[methyl(pyridin-4-ylmethyl)amino]phenyl]methanol
PubChem CID43564416
Molecular FormulaC14H15ClN2O
Molecular Weight262.74 g/mol
Exact Mass262.09
IUPAC Name[2-chloro-6-[methyl(pyridin-4-ylmethyl)amino]phenyl]methanol
SMILESCN(Cc1ccncc1)c1cccc(Cl)c1CO
InChIInChI=1S/C14H15ClN2O/c1-17(9-11-5-7-16-8-6-11)14-4-2-3-13(15)12(14)10-18/h2-8,18H,9-10H2,1H3
InChIKeyOUXVPLIXXQEGTO-UHFFFAOYSA-N
XLogP2.86
TPSA36.36 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 ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-chloro-N-methyl-2-(methylaminomethyl)-N-(pyridin-4-ylmethyl)aniline
CID 43564469
[3-chloro-2-[methyl(pyridin-4-ylmethyl)amino]phenyl]methanol
CID 114067411
3-chloro-2-(chloromethyl)-N-methyl-N-(pyridin-3-ylmethyl)aniline
CID 43563593
2-(aminomethyl)-3-fluoro-N-methyl-N-(pyridin-4-ylmethyl)aniline
CID 79517600
2-(aminomethyl)-3-chloro-N-methyl-N-(pyridin-3-ylmethyl)aniline
CID 43563639
5-[3-chloro-2-(hydroxymethyl)-N-methylanilino]pentan-1-ol
CID 107200860
3-chloro-N-methyl-2-(methylaminomethyl)-N-(2-pyridin-4-ylethyl)aniline
CID 60912716
[3-chloro-6-[methyl(pyridin-4-ylmethyl)amino]-2-pyridinyl]methanol
CID 61255835
3-[2-(2-chloro-6-fluorophenyl)ethyl]-1-methyl-1-(pyridin-4-ylmethyl)urea
CID 71969304
2,3-dichloro-N-methyl-N-(2-pyridin-4-ylethyl)aniline
CID 110454690
2-(aminomethyl)-3-chloro-N-methyl-N-(pyridin-2-ylmethyl)aniline
CID 43565251
4-(chloromethyl)-N-methyl-N-(pyridin-4-ylmethyl)pyridin-3-amine
CID 105067321

Frequently Asked Questions

What is the IUPAC name of [2-chloro-6-[methyl(pyridin-4-ylmethyl)amino]phenyl]methanol?
The IUPAC name of [2-chloro-6-[methyl(pyridin-4-ylmethyl)amino]phenyl]methanol (CID 43564416) is [2-chloro-6-[methyl(pyridin-4-ylmethyl)amino]phenyl]methanol.
What is the SMILES notation for [2-chloro-6-[methyl(pyridin-4-ylmethyl)amino]phenyl]methanol?
The canonical SMILES for [2-chloro-6-[methyl(pyridin-4-ylmethyl)amino]phenyl]methanol is CN(Cc1ccncc1)c1cccc(Cl)c1CO.
What is the InChIKey of [2-chloro-6-[methyl(pyridin-4-ylmethyl)amino]phenyl]methanol?
The InChIKey is OUXVPLIXXQEGTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2O/c1-17(9-11-5-7-16-8-6-11)14-4-2-3-13(15)12(14)10-18/h2-8,18H,9-10H2,1H3.
What are the key properties of [2-chloro-6-[methyl(pyridin-4-ylmethyl)amino]phenyl]methanol?
[2-chloro-6-[methyl(pyridin-4-ylmethyl)amino]phenyl]methanol has a molecular weight of 262.74 g/mol, XLogP of 2.86, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-chloro-6-[methyl(pyridin-4-ylmethyl)amino]phenyl]methanol is sourced from PubChem (CID 43564416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).