[4-[2-(aminomethyl)-6-chlorophenoxy]phenyl]methanol

C14H14ClNO2 — CID 114069405

IUPAC[4-[2-(aminomethyl)-6-chlorophenoxy]phenyl]methanol
SMILESNCc1cccc(Cl)c1Oc1ccc(CO)cc1
InChIInChI=1S/C14H14ClNO2/c15-13-3-1-2-11(8-16)14(13)18-12-6-4-10(9-17)5-7-12/h1-7,17H,8-9,16H2
InChIKeyWQPWOAZXTLRCCU-UHFFFAOYSA-N
MW263.72 g/mol
LogP3.08
Rot. Bonds4

About [4-[2-(aminomethyl)-6-chlorophenoxy]phenyl]methanol

[4-[2-(aminomethyl)-6-chlorophenoxy]phenyl]methanol (PubChem CID 114069405) has the molecular formula C14H14ClNO2 and a molecular weight of 263.72 g/mol. Its IUPAC name is [4-[2-(aminomethyl)-6-chlorophenoxy]phenyl]methanol.

Molecular Properties

Compound Name[4-[2-(aminomethyl)-6-chlorophenoxy]phenyl]methanol
PubChem CID114069405
Molecular FormulaC14H14ClNO2
Molecular Weight263.72 g/mol
Exact Mass263.07
IUPAC Name[4-[2-(aminomethyl)-6-chlorophenoxy]phenyl]methanol
SMILESNCc1cccc(Cl)c1Oc1ccc(CO)cc1
InChIInChI=1S/C14H14ClNO2/c15-13-3-1-2-11(8-16)14(13)18-12-6-4-10(9-17)5-7-12/h1-7,17H,8-9,16H2
InChIKeyWQPWOAZXTLRCCU-UHFFFAOYSA-N
XLogP3.08
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.72
LogP ≤ 53.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze [4-[2-(aminomethyl)-6-chlorophenoxy]phenyl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[4-[2-chloro-6-(hydroxymethyl)phenoxy]phenyl]methanol
CID 114067626
[3-chloro-2-(4-iodophenoxy)phenyl]methanamine
CID 114069346
[3-chloro-2-(4-fluorophenoxy)phenyl]methanol
CID 114067610
[3-chloro-2-(3,5-dichlorophenoxy)phenyl]methanol
CID 114067624
[4-(2-chlorophenoxy)phenyl]methanamine
CID 5152206
1-chloro-3-(chloromethyl)-2-(4-methoxyphenoxy)benzene
CID 114067983
2-[4-[2-(bromomethyl)-6-chlorophenoxy]phenyl]acetonitrile
CID 114067965
2-chloro-6-[4-(hydroxymethyl)phenoxy]benzonitrile
CID 62495723
[4-[2-(aminomethyl)-5-methylphenoxy]phenyl]methanol
CID 62306971
[4-[(6-chloro-2-pyridinyl)oxy]phenyl]methanol
CID 63586509
2-(4-butylphenoxy)-3-chloroaniline
CID 115492204
1-[[2-(aminomethyl)-6-chlorophenoxy]methyl]cyclopentan-1-ol
CID 112607841

Frequently Asked Questions

What is the IUPAC name of [4-[2-(aminomethyl)-6-chlorophenoxy]phenyl]methanol?
The IUPAC name of [4-[2-(aminomethyl)-6-chlorophenoxy]phenyl]methanol (CID 114069405) is [4-[2-(aminomethyl)-6-chlorophenoxy]phenyl]methanol.
What is the SMILES notation for [4-[2-(aminomethyl)-6-chlorophenoxy]phenyl]methanol?
The canonical SMILES for [4-[2-(aminomethyl)-6-chlorophenoxy]phenyl]methanol is NCc1cccc(Cl)c1Oc1ccc(CO)cc1.
What is the InChIKey of [4-[2-(aminomethyl)-6-chlorophenoxy]phenyl]methanol?
The InChIKey is WQPWOAZXTLRCCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClNO2/c15-13-3-1-2-11(8-16)14(13)18-12-6-4-10(9-17)5-7-12/h1-7,17H,8-9,16H2.
What are the key properties of [4-[2-(aminomethyl)-6-chlorophenoxy]phenyl]methanol?
[4-[2-(aminomethyl)-6-chlorophenoxy]phenyl]methanol has a molecular weight of 263.72 g/mol, XLogP of 3.08, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[2-(aminomethyl)-6-chlorophenoxy]phenyl]methanol is sourced from PubChem (CID 114069405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).