1-(cyclopropylmethoxy)-4-ethyl-2-methylbenzene

C13H18O — CID 155323138

IUPAC1-(cyclopropylmethoxy)-4-ethyl-2-methylbenzene
SMILESCCc1ccc(OCC2CC2)c(C)c1
InChIInChI=1S/C13H18O/c1-3-11-6-7-13(10(2)8-11)14-9-12-4-5-12/h6-8,12H,3-5,9H2,1-2H3
InChIKeyYECYFFPGXVSZRN-UHFFFAOYSA-N
MW190.29 g/mol
LogP3.35
Rot. Bonds4

About 1-(cyclopropylmethoxy)-4-ethyl-2-methylbenzene

1-(cyclopropylmethoxy)-4-ethyl-2-methylbenzene (PubChem CID 155323138) has the molecular formula C13H18O and a molecular weight of 190.29 g/mol. Its IUPAC name is 1-(cyclopropylmethoxy)-4-ethyl-2-methylbenzene.

Molecular Properties

Compound Name1-(cyclopropylmethoxy)-4-ethyl-2-methylbenzene
PubChem CID155323138
Molecular FormulaC13H18O
Molecular Weight190.29 g/mol
Exact Mass190.14
IUPAC Name1-(cyclopropylmethoxy)-4-ethyl-2-methylbenzene
SMILESCCc1ccc(OCC2CC2)c(C)c1
InChIInChI=1S/C13H18O/c1-3-11-6-7-13(10(2)8-11)14-9-12-4-5-12/h6-8,12H,3-5,9H2,1-2H3
InChIKeyYECYFFPGXVSZRN-UHFFFAOYSA-N
XLogP3.35
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1-(cyclopropylmethoxy)-4-ethyl-2-methylbenzene 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-chloro-1-(cyclobutylmethoxy)-2-methylbenzene
CID 127017270
[3-(cyclopropylmethoxy)-4-methylphenyl]methanamine
CID 107655653
4-[(2-chloro-4-ethylphenoxy)methyl]piperidine;hydrochloride
CID 56830834
2-cyclopentyloxy-4-ethyl-1-methoxybenzene;2-cyclopentyloxy-1-methoxy-4-methylbenzene;2-(cyclopropylmethoxy)-1-methoxy-4-methylbenzene
CID 158580176
2-(cyclopropylmethoxy)-1,4-dimethylbenzene
CID 160770501
N-[1-[4-(cyclopropylmethoxy)-3-methylphenyl]ethyl]propan-1-amine
CID 113386847
2-(cyclopropylmethoxy)-4-fluoro-1-methylbenzene;propane
CID 162532018
4-[4-(cyclopropylmethoxy)-3-methylphenyl]but-3-yn-1-ol
CID 63214585
1-(cyclohexylmethoxy)-4-ethynyl-2-methylbenzene
CID 138962091
4-(chloromethyl)-2-(cyclopropylmethoxy)-1-methoxybenzene
CID 22456846
N-butyl-3-methyl-4-[(4-pentylcyclohexyl)methoxy]aniline
CID 19008449
(3S)-3-[(4-iodo-2-methylphenoxy)methyl]pyrrolidine;hydrochloride
CID 166175538

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylmethoxy)-4-ethyl-2-methylbenzene?
The IUPAC name of 1-(cyclopropylmethoxy)-4-ethyl-2-methylbenzene (CID 155323138) is 1-(cyclopropylmethoxy)-4-ethyl-2-methylbenzene.
What is the SMILES notation for 1-(cyclopropylmethoxy)-4-ethyl-2-methylbenzene?
The canonical SMILES for 1-(cyclopropylmethoxy)-4-ethyl-2-methylbenzene is CCc1ccc(OCC2CC2)c(C)c1.
What is the InChIKey of 1-(cyclopropylmethoxy)-4-ethyl-2-methylbenzene?
The InChIKey is YECYFFPGXVSZRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18O/c1-3-11-6-7-13(10(2)8-11)14-9-12-4-5-12/h6-8,12H,3-5,9H2,1-2H3.
What are the key properties of 1-(cyclopropylmethoxy)-4-ethyl-2-methylbenzene?
1-(cyclopropylmethoxy)-4-ethyl-2-methylbenzene has a molecular weight of 190.29 g/mol, XLogP of 3.35, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylmethoxy)-4-ethyl-2-methylbenzene is sourced from PubChem (CID 155323138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).