ethanamine;1-methoxy-4-propylbenzene

C12H21NO — CID 19382800

IUPACethanamine;1-methoxy-4-propylbenzene
SMILESCCCc1ccc(OC)cc1.CCN
InChIInChI=1S/C10H14O.C2H7N/c1-3-4-9-5-7-10(11-2)8-6-9;1-2-3/h5-8H,3-4H2,1-2H3;2-3H2,1H3
InChIKeyLLXOIUVPGYGIST-UHFFFAOYSA-N
MW195.31 g/mol
LogP2.61
Rot. Bonds3

About ethanamine;1-methoxy-4-propylbenzene

ethanamine;1-methoxy-4-propylbenzene (PubChem CID 19382800) has the molecular formula C12H21NO and a molecular weight of 195.31 g/mol. Its IUPAC name is ethanamine;1-methoxy-4-propylbenzene.

Molecular Properties

Compound Nameethanamine;1-methoxy-4-propylbenzene
PubChem CID19382800
Molecular FormulaC12H21NO
Molecular Weight195.31 g/mol
Exact Mass195.16
IUPAC Nameethanamine;1-methoxy-4-propylbenzene
SMILESCCCc1ccc(OC)cc1.CCN
InChIInChI=1S/C10H14O.C2H7N/c1-3-4-9-5-7-10(11-2)8-6-9;1-2-3/h5-8H,3-4H2,1-2H3;2-3H2,1H3
InChIKeyLLXOIUVPGYGIST-UHFFFAOYSA-N
XLogP2.61
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;1-methoxy-4-propylbenzene
CID 142085762
1-methoxy-4-[(4-propylphenyl)methyl]benzene
CID 67608407
potassium;ethane;1-methanidyl-4-methoxybenzene;1-methoxy-4-propylbenzene
CID 172578075
(4-propylphenyl) hypochlorite
CID 175330115
1-[bromo-(4-methoxyphenyl)methyl]-4-propylbenzene
CID 63440600
3-(4-methoxyphenyl)-1-(4-propylphenyl)propan-1-amine
CID 43099758
N-[2-(4-methoxyphenyl)ethyl]-4-propylaniline
CID 65429365
3-(4-methoxyphenyl)-6-(4-propylphenyl)pyridazine
CID 14669906
3-(4-methoxyphenyl)propan-1-amine;hydrochloride
CID 3029814
4-(4-methoxyphenyl)butan-1-amine;hydrochloride
CID 22715047
5-(4-methoxyphenyl)pentan-1-amine
CID 11507342
10-(4-methoxyphenyl)decan-1-amine
CID 70566558

Frequently Asked Questions

What is the IUPAC name of ethanamine;1-methoxy-4-propylbenzene?
The IUPAC name of ethanamine;1-methoxy-4-propylbenzene (CID 19382800) is ethanamine;1-methoxy-4-propylbenzene.
What is the SMILES notation for ethanamine;1-methoxy-4-propylbenzene?
The canonical SMILES for ethanamine;1-methoxy-4-propylbenzene is CCCc1ccc(OC)cc1.CCN.
What is the InChIKey of ethanamine;1-methoxy-4-propylbenzene?
The InChIKey is LLXOIUVPGYGIST-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14O.C2H7N/c1-3-4-9-5-7-10(11-2)8-6-9;1-2-3/h5-8H,3-4H2,1-2H3;2-3H2,1H3.
What are the key properties of ethanamine;1-methoxy-4-propylbenzene?
ethanamine;1-methoxy-4-propylbenzene has a molecular weight of 195.31 g/mol, XLogP of 2.61, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethanamine;1-methoxy-4-propylbenzene is sourced from PubChem (CID 19382800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).