1-[4-[(2-methylphenyl)methoxy]phenyl]propan-2-ol

C17H20O2 — CID 115496013

IUPAC1-[4-[(2-methylphenyl)methoxy]phenyl]propan-2-ol
SMILESCc1ccccc1COc1ccc(CC(C)O)cc1
InChIInChI=1S/C17H20O2/c1-13-5-3-4-6-16(13)12-19-17-9-7-15(8-10-17)11-14(2)18/h3-10,14,18H,11-12H2,1-2H3
InChIKeyHGFIXJLABCLRFL-UHFFFAOYSA-N
MW256.34 g/mol
LogP3.50
Rot. Bonds5

About 1-[4-[(2-methylphenyl)methoxy]phenyl]propan-2-ol

1-[4-[(2-methylphenyl)methoxy]phenyl]propan-2-ol (PubChem CID 115496013) has the molecular formula C17H20O2 and a molecular weight of 256.34 g/mol. Its IUPAC name is 1-[4-[(2-methylphenyl)methoxy]phenyl]propan-2-ol.

Molecular Properties

Compound Name1-[4-[(2-methylphenyl)methoxy]phenyl]propan-2-ol
PubChem CID115496013
Molecular FormulaC17H20O2
Molecular Weight256.34 g/mol
Exact Mass256.15
IUPAC Name1-[4-[(2-methylphenyl)methoxy]phenyl]propan-2-ol
SMILESCc1ccccc1COc1ccc(CC(C)O)cc1
InChIInChI=1S/C17H20O2/c1-13-5-3-4-6-16(13)12-19-17-9-7-15(8-10-17)11-14(2)18/h3-10,14,18H,11-12H2,1-2H3
InChIKeyHGFIXJLABCLRFL-UHFFFAOYSA-N
XLogP3.50
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.34
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(aminomethyl)-3-[4-[(2-methylphenyl)methoxy]phenyl]propan-1-ol
CID 83977208
1-[4-[(3-methyl-2-pyridinyl)methoxy]phenyl]propan-2-ol
CID 112650663
1-[4-[(2,3-difluorophenyl)methoxy]phenyl]propan-2-ol
CID 115495872
1-[4-(4-phenylmethoxyphenyl)phenyl]propan-2-ol
CID 18927881
4-[1-amino-3-[4-[(2-methylphenyl)methoxy]phenyl]propan-2-yl]phenol
CID 112539060
1-[4-[(2-fluoro-3-methoxyphenyl)methoxy]phenyl]propan-2-ol
CID 104792506
2-[4-[(2-methylphenyl)methoxy]phenyl]ethanamine
CID 16775885
1-[4-(thiophen-2-ylmethoxy)phenyl]propan-2-ol
CID 115496016
1-[4-(phenylmethoxymethoxy)phenyl]propan-2-ol
CID 102939869
N-(2-hydroxyethyl)-2-[4-[(2-methylphenyl)methoxy]phenyl]acetamide
CID 111112371
2-(4-fluorophenyl)-3-[4-[(2-methylphenyl)methoxy]phenyl]propan-1-amine
CID 112538903
3-methyl-2-[[4-[(2-methylphenyl)methoxy]phenyl]methylamino]butanoic acid
CID 66528504

Frequently Asked Questions

What is the IUPAC name of 1-[4-[(2-methylphenyl)methoxy]phenyl]propan-2-ol?
The IUPAC name of 1-[4-[(2-methylphenyl)methoxy]phenyl]propan-2-ol (CID 115496013) is 1-[4-[(2-methylphenyl)methoxy]phenyl]propan-2-ol.
What is the SMILES notation for 1-[4-[(2-methylphenyl)methoxy]phenyl]propan-2-ol?
The canonical SMILES for 1-[4-[(2-methylphenyl)methoxy]phenyl]propan-2-ol is Cc1ccccc1COc1ccc(CC(C)O)cc1.
What is the InChIKey of 1-[4-[(2-methylphenyl)methoxy]phenyl]propan-2-ol?
The InChIKey is HGFIXJLABCLRFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20O2/c1-13-5-3-4-6-16(13)12-19-17-9-7-15(8-10-17)11-14(2)18/h3-10,14,18H,11-12H2,1-2H3.
What are the key properties of 1-[4-[(2-methylphenyl)methoxy]phenyl]propan-2-ol?
1-[4-[(2-methylphenyl)methoxy]phenyl]propan-2-ol has a molecular weight of 256.34 g/mol, XLogP of 3.50, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[(2-methylphenyl)methoxy]phenyl]propan-2-ol is sourced from PubChem (CID 115496013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).