(4-aminophenyl)-(5-chloro-2-methoxyphenyl)methanol

C14H14ClNO2 — CID 106695594

IUPAC(4-aminophenyl)-(5-chloro-2-methoxyphenyl)methanol
SMILESCOc1ccc(Cl)cc1C(O)c1ccc(N)cc1
InChIInChI=1S/C14H14ClNO2/c1-18-13-7-4-10(15)8-12(13)14(17)9-2-5-11(16)6-3-9/h2-8,14,17H,16H2,1H3
InChIKeyLRCPHKYQMSXIEF-UHFFFAOYSA-N
MW263.72 g/mol
LogP3.01
Rot. Bonds3

About (4-aminophenyl)-(5-chloro-2-methoxyphenyl)methanol

(4-aminophenyl)-(5-chloro-2-methoxyphenyl)methanol (PubChem CID 106695594) has the molecular formula C14H14ClNO2 and a molecular weight of 263.72 g/mol. Its IUPAC name is (4-aminophenyl)-(5-chloro-2-methoxyphenyl)methanol.

Molecular Properties

Compound Name(4-aminophenyl)-(5-chloro-2-methoxyphenyl)methanol
PubChem CID106695594
Molecular FormulaC14H14ClNO2
Molecular Weight263.72 g/mol
Exact Mass263.07
IUPAC Name(4-aminophenyl)-(5-chloro-2-methoxyphenyl)methanol
SMILESCOc1ccc(Cl)cc1C(O)c1ccc(N)cc1
InChIInChI=1S/C14H14ClNO2/c1-18-13-7-4-10(15)8-12(13)14(17)9-2-5-11(16)6-3-9/h2-8,14,17H,16H2,1H3
InChIKeyLRCPHKYQMSXIEF-UHFFFAOYSA-N
XLogP3.01
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.72
LogP ≤ 53.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

(5-chloro-2-methoxyphenyl)-[4-(difluoromethyl)phenyl]methanol
CID 115525000
(5-chloro-2-methoxyphenyl)-[4-(trifluoromethyl)phenyl]methanol
CID 63896012
(4-chloro-3-fluorophenyl)-(5-chloro-2-methoxyphenyl)methanol
CID 63895530
(5-chloro-2-methoxyphenyl)-(furan-3-yl)methanol
CID 63894957
(4-chlorophenyl)-(2,4,5-trimethoxyphenyl)methanol
CID 61101584
(5-chloro-2-methoxyphenyl)-(2,4,5-trifluorophenyl)methanol
CID 103303352
(5-chloro-2-fluorophenyl)-(4-methoxy-3-methylphenyl)methanol
CID 61081454
(1S,2R)-1-amino-1-(5-chloro-2-methoxyphenyl)propan-2-ol
CID 130749346
(5-chloro-2-fluorophenyl)-(5-fluoro-2-methoxyphenyl)methanol
CID 61087442
(3-chloro-4-methoxyphenyl)-(2,4-dichlorophenyl)methanol
CID 61101565
(5-chloro-2-methoxyphenyl)-[3-(difluoromethoxy)phenyl]methanol
CID 104546174
(5-chloro-2-methoxyphenyl)-(3-propylphenyl)methanol
CID 115838131

Frequently Asked Questions

What is the IUPAC name of (4-aminophenyl)-(5-chloro-2-methoxyphenyl)methanol?
The IUPAC name of (4-aminophenyl)-(5-chloro-2-methoxyphenyl)methanol (CID 106695594) is (4-aminophenyl)-(5-chloro-2-methoxyphenyl)methanol.
What is the SMILES notation for (4-aminophenyl)-(5-chloro-2-methoxyphenyl)methanol?
The canonical SMILES for (4-aminophenyl)-(5-chloro-2-methoxyphenyl)methanol is COc1ccc(Cl)cc1C(O)c1ccc(N)cc1.
What is the InChIKey of (4-aminophenyl)-(5-chloro-2-methoxyphenyl)methanol?
The InChIKey is LRCPHKYQMSXIEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClNO2/c1-18-13-7-4-10(15)8-12(13)14(17)9-2-5-11(16)6-3-9/h2-8,14,17H,16H2,1H3.
What are the key properties of (4-aminophenyl)-(5-chloro-2-methoxyphenyl)methanol?
(4-aminophenyl)-(5-chloro-2-methoxyphenyl)methanol has a molecular weight of 263.72 g/mol, XLogP of 3.01, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-aminophenyl)-(5-chloro-2-methoxyphenyl)methanol is sourced from PubChem (CID 106695594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).