2-methyl-6-propyl-3-(quinolin-2-ylmethoxy)phenol

C20H21NO2 — CID 57174515

IUPAC2-methyl-6-propyl-3-(quinolin-2-ylmethoxy)phenol
SMILESCCCc1ccc(OCc2ccc3ccccc3n2)c(C)c1O
InChIInChI=1S/C20H21NO2/c1-3-6-16-10-12-19(14(2)20(16)22)23-13-17-11-9-15-7-4-5-8-18(15)21-17/h4-5,7-12,22H,3,6,13H2,1-2H3
InChIKeyLHMIRYHWIAWECK-UHFFFAOYSA-N
MW307.39 g/mol
LogP4.78
Rot. Bonds5

About 2-methyl-6-propyl-3-(quinolin-2-ylmethoxy)phenol

2-methyl-6-propyl-3-(quinolin-2-ylmethoxy)phenol (PubChem CID 57174515) has the molecular formula C20H21NO2 and a molecular weight of 307.39 g/mol. Its IUPAC name is 2-methyl-6-propyl-3-(quinolin-2-ylmethoxy)phenol.

Molecular Properties

Compound Name2-methyl-6-propyl-3-(quinolin-2-ylmethoxy)phenol
PubChem CID57174515
Molecular FormulaC20H21NO2
Molecular Weight307.39 g/mol
Exact Mass307.16
IUPAC Name2-methyl-6-propyl-3-(quinolin-2-ylmethoxy)phenol
SMILESCCCc1ccc(OCc2ccc3ccccc3n2)c(C)c1O
InChIInChI=1S/C20H21NO2/c1-3-6-16-10-12-19(14(2)20(16)22)23-13-17-11-9-15-7-4-5-8-18(15)21-17/h4-5,7-12,22H,3,6,13H2,1-2H3
InChIKeyLHMIRYHWIAWECK-UHFFFAOYSA-N
XLogP4.78
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.39
LogP ≤ 54.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 2-[3-propyl-4-(quinolin-2-ylmethoxy)phenyl]acetate
CID 19087783
2-[2-methyl-6-(propoxymethyl)-3-(quinolin-2-ylmethoxy)phenoxy]acetic acid
CID 70133366
[6-methyl-3-(quinolin-2-ylmethoxy)-2-pyridinyl]methanol
CID 79157803
3-methoxy-4-(quinolin-2-ylmethoxy)phenol;3-methyl-4-(quinolin-2-ylmethoxy)phenol
CID 70388723
2-[[4-[(4-propylphenyl)methoxy]phenoxy]methyl]quinoline
CID 57057623
methyl 3-[2-hydroxy-3-pyridin-4-yl-4-(quinolin-2-ylmethoxy)phenyl]propanoate
CID 140565579
4-methyl-2-(quinolin-2-ylmethoxy)aniline
CID 28773260
4-methoxy-3-(quinolin-2-ylmethoxy)benzoic acid
CID 5074844
2-(quinolin-2-ylmethoxy)benzoate
CID 6919840
ethyl 5-[4-phenylmethoxy-3-(quinolin-2-ylmethoxy)phenyl]pentanoate
CID 20597952
2-[(2-bromo-4-methoxyphenoxy)methyl]quinoline
CID 104707445
2-(dodecoxymethyl)quinoline
CID 14754989

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-propyl-3-(quinolin-2-ylmethoxy)phenol?
The IUPAC name of 2-methyl-6-propyl-3-(quinolin-2-ylmethoxy)phenol (CID 57174515) is 2-methyl-6-propyl-3-(quinolin-2-ylmethoxy)phenol.
What is the SMILES notation for 2-methyl-6-propyl-3-(quinolin-2-ylmethoxy)phenol?
The canonical SMILES for 2-methyl-6-propyl-3-(quinolin-2-ylmethoxy)phenol is CCCc1ccc(OCc2ccc3ccccc3n2)c(C)c1O.
What is the InChIKey of 2-methyl-6-propyl-3-(quinolin-2-ylmethoxy)phenol?
The InChIKey is LHMIRYHWIAWECK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21NO2/c1-3-6-16-10-12-19(14(2)20(16)22)23-13-17-11-9-15-7-4-5-8-18(15)21-17/h4-5,7-12,22H,3,6,13H2,1-2H3.
What are the key properties of 2-methyl-6-propyl-3-(quinolin-2-ylmethoxy)phenol?
2-methyl-6-propyl-3-(quinolin-2-ylmethoxy)phenol has a molecular weight of 307.39 g/mol, XLogP of 4.78, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-propyl-3-(quinolin-2-ylmethoxy)phenol is sourced from PubChem (CID 57174515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).