4-[[4-(2-aminoethoxy)phenyl]-cyclohexylidenemethyl]phenol

C21H25NO2 — CID 23728510

IUPAC4-[[4-(2-aminoethoxy)phenyl]-cyclohexylidenemethyl]phenol
SMILESNCCOc1ccc(C(=C2CCCCC2)c2ccc(O)cc2)cc1
InChIInChI=1S/C21H25NO2/c22-14-15-24-20-12-8-18(9-13-20)21(16-4-2-1-3-5-16)17-6-10-19(23)11-7-17/h6-13,23H,1-5,14-15,22H2
InChIKeyBAXLOXCPKVICBE-UHFFFAOYSA-N
MW323.44 g/mol
LogP4.50
Rot. Bonds5

About 4-[[4-(2-aminoethoxy)phenyl]-cyclohexylidenemethyl]phenol

4-[[4-(2-aminoethoxy)phenyl]-cyclohexylidenemethyl]phenol (PubChem CID 23728510) has the molecular formula C21H25NO2 and a molecular weight of 323.44 g/mol. Its IUPAC name is 4-[[4-(2-aminoethoxy)phenyl]-cyclohexylidenemethyl]phenol.

Molecular Properties

Compound Name4-[[4-(2-aminoethoxy)phenyl]-cyclohexylidenemethyl]phenol
PubChem CID23728510
Molecular FormulaC21H25NO2
Molecular Weight323.44 g/mol
Exact Mass323.19
IUPAC Name4-[[4-(2-aminoethoxy)phenyl]-cyclohexylidenemethyl]phenol
SMILESNCCOc1ccc(C(=C2CCCCC2)c2ccc(O)cc2)cc1
InChIInChI=1S/C21H25NO2/c22-14-15-24-20-12-8-18(9-13-20)21(16-4-2-1-3-5-16)17-6-10-19(23)11-7-17/h6-13,23H,1-5,14-15,22H2
InChIKeyBAXLOXCPKVICBE-UHFFFAOYSA-N
XLogP4.50
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.44
LogP ≤ 54.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[cyclohexylidene-[4-[2-(dimethylamino)ethoxy]phenyl]methyl]phenol
CID 86155740
4-[cycloheptylidene-(4-hydroxyphenyl)methyl]phenol
CID 11587420
4-[cyclooctylidene-(4-phenylmethoxyphenyl)methyl]phenol
CID 69163901
ethyl 6-[4-[cyclohexylidene-(4-hydroxyphenyl)methyl]phenoxy]hexanoate
CID 46202250
4-[cyclohexylidene-[4-[2-[3-(fluoromethyl)azetidin-1-yl]ethoxy]phenyl]methyl]phenol
CID 121427054
4-[(E)-1-[4-(2-aminoethoxy)phenyl]-1-(4-hydroxyphenyl)but-1-en-2-yl]phenol
CID 73386689
2-[4-(2-aminoethoxy)phenoxy]ethanamine;dihydrochloride
CID 46786149
4-[1-[4-(2-aminoethoxy)phenyl]-4-chloro-1-phenylbut-1-en-2-yl]phenol
CID 165015784
ethyl 3-[4-[cyclohexylidene-(4-hydroxyphenyl)methyl]phenyl]prop-2-enoate
CID 75146663
4-(2-aminoethoxy)-N-cyclohexylbenzamide
CID 22362508
4-[2-adamantylidene-[4-(3-aminopropoxy)phenyl]methyl]phenol;3-aminopropan-1-ol
CID 160816106
4-[5-(4-hydroxyphenoxy)pentoxy]phenol
CID 20548963

Frequently Asked Questions

What is the IUPAC name of 4-[[4-(2-aminoethoxy)phenyl]-cyclohexylidenemethyl]phenol?
The IUPAC name of 4-[[4-(2-aminoethoxy)phenyl]-cyclohexylidenemethyl]phenol (CID 23728510) is 4-[[4-(2-aminoethoxy)phenyl]-cyclohexylidenemethyl]phenol.
What is the SMILES notation for 4-[[4-(2-aminoethoxy)phenyl]-cyclohexylidenemethyl]phenol?
The canonical SMILES for 4-[[4-(2-aminoethoxy)phenyl]-cyclohexylidenemethyl]phenol is NCCOc1ccc(C(=C2CCCCC2)c2ccc(O)cc2)cc1.
What is the InChIKey of 4-[[4-(2-aminoethoxy)phenyl]-cyclohexylidenemethyl]phenol?
The InChIKey is BAXLOXCPKVICBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25NO2/c22-14-15-24-20-12-8-18(9-13-20)21(16-4-2-1-3-5-16)17-6-10-19(23)11-7-17/h6-13,23H,1-5,14-15,22H2.
What are the key properties of 4-[[4-(2-aminoethoxy)phenyl]-cyclohexylidenemethyl]phenol?
4-[[4-(2-aminoethoxy)phenyl]-cyclohexylidenemethyl]phenol has a molecular weight of 323.44 g/mol, XLogP of 4.50, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[4-(2-aminoethoxy)phenyl]-cyclohexylidenemethyl]phenol is sourced from PubChem (CID 23728510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).