cyclopropylmethoxybenzene

C10H12O — CID 12712156

IUPACcyclopropylmethoxybenzene
SMILESc1ccc(OCC2CC2)cc1
InChIInChI=1S/C10H12O/c1-2-4-10(5-3-1)11-8-9-6-7-9/h1-5,9H,6-8H2
InChIKeyYRKRNZMULKLCJF-UHFFFAOYSA-N
MW148.20 g/mol
LogP2.48
Rot. Bonds3

About cyclopropylmethoxybenzene

cyclopropylmethoxybenzene (PubChem CID 12712156) has the molecular formula C10H12O and a molecular weight of 148.20 g/mol. Its IUPAC name is cyclopropylmethoxybenzene.

Molecular Properties

Compound Namecyclopropylmethoxybenzene
PubChem CID12712156
Molecular FormulaC10H12O
Molecular Weight148.20 g/mol
Exact Mass148.09
IUPAC Namecyclopropylmethoxybenzene
SMILESc1ccc(OCC2CC2)cc1
InChIInChI=1S/C10H12O/c1-2-4-10(5-3-1)11-8-9-6-7-9/h1-5,9H,6-8H2
InChIKeyYRKRNZMULKLCJF-UHFFFAOYSA-N
XLogP2.48
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.20
LogP ≤ 52.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

cyclohexylmethoxybenzene
CID 14399287
(4-prop-2-enylcyclohexyl)methoxybenzene
CID 70544247
3-(phenoxymethyl)cyclopentan-1-amine
CID 83618605
(1S,5R)-3-(phenoxymethyl)bicyclo[3.2.1]octane
CID 70660865
(4-hexylcyclohexyl)methoxybenzene
CID 57019623
1-ethyl-4-(phenoxymethyl)piperidine
CID 91434819
1-benzyl-4-(phenoxymethyl)piperidine
CID 18919890
1-(cyclohexylmethoxy)-4-phenylbenzene
CID 59950067
(3R)-3-(phenoxymethyl)pyrrolidine
CID 26192487
4-[[4-[(4-hydroxyphenoxy)methyl]cyclohexyl]methoxy]phenol
CID 118229789
[(2S,5S)-5-(phenoxymethyl)oxan-2-yl]methanamine
CID 129389570
(3S)-3-(phenoxymethyl)piperidine
CID 26190643

Frequently Asked Questions

What is the IUPAC name of cyclopropylmethoxybenzene?
The IUPAC name of cyclopropylmethoxybenzene (CID 12712156) is cyclopropylmethoxybenzene.
What is the SMILES notation for cyclopropylmethoxybenzene?
The canonical SMILES for cyclopropylmethoxybenzene is c1ccc(OCC2CC2)cc1.
What is the InChIKey of cyclopropylmethoxybenzene?
The InChIKey is YRKRNZMULKLCJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12O/c1-2-4-10(5-3-1)11-8-9-6-7-9/h1-5,9H,6-8H2.
What are the key properties of cyclopropylmethoxybenzene?
cyclopropylmethoxybenzene has a molecular weight of 148.20 g/mol, XLogP of 2.48, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropylmethoxybenzene is sourced from PubChem (CID 12712156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).