2-(ethoxymethyl)-N-(3-methylcyclopentyl)aniline

C15H23NO — CID 64500672

IUPAC2-(ethoxymethyl)-N-(3-methylcyclopentyl)aniline
SMILESCCOCc1ccccc1NC1CCC(C)C1
InChIInChI=1S/C15H23NO/c1-3-17-11-13-6-4-5-7-15(13)16-14-9-8-12(2)10-14/h4-7,12,14,16H,3,8-11H2,1-2H3
InChIKeyQWIBKALYNBFHIU-UHFFFAOYSA-N
MW233.35 g/mol
LogP3.82
Rot. Bonds5

About 2-(ethoxymethyl)-N-(3-methylcyclopentyl)aniline

2-(ethoxymethyl)-N-(3-methylcyclopentyl)aniline (PubChem CID 64500672) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is 2-(ethoxymethyl)-N-(3-methylcyclopentyl)aniline.

Molecular Properties

Compound Name2-(ethoxymethyl)-N-(3-methylcyclopentyl)aniline
PubChem CID64500672
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC Name2-(ethoxymethyl)-N-(3-methylcyclopentyl)aniline
SMILESCCOCc1ccccc1NC1CCC(C)C1
InChIInChI=1S/C15H23NO/c1-3-17-11-13-6-4-5-7-15(13)16-14-9-8-12(2)10-14/h4-7,12,14,16H,3,8-11H2,1-2H3
InChIKeyQWIBKALYNBFHIU-UHFFFAOYSA-N
XLogP3.82
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(ethoxymethyl)phenyl]cycloheptanamine
CID 43750302
N-[2-(ethoxymethyl)phenyl]-5-methylthiolan-3-amine
CID 79941827
N-(3-methylcyclopentyl)-2-(pyrazol-1-ylmethyl)aniline
CID 64501283
N-[2-(ethoxymethyl)phenyl]-2,2-dimethyl-1,3-dioxan-5-amine
CID 106658557
N-[2-(ethoxymethyl)phenyl]-1-(2-methylpropyl)piperidin-4-amine
CID 103931357
2-methoxy-N-[(1R,3S)-3-methylcyclopentyl]aniline
CID 95376142
2-bromo-N-(3-methylcyclopentyl)aniline
CID 64501645
N-(3-methylcyclopentyl)-2-(trifluoromethyl)aniline
CID 64501837
N-[2-(ethoxymethyl)phenyl]-5,5-dimethylthian-3-amine
CID 79958221
2-[(dimethylamino)methyl]-N-(3-methylcyclobutyl)aniline
CID 104859978
2-(ethoxymethyl)-N-ethylaniline
CID 43750443
2-(diethylaminomethyl)-N-(3,5-dimethylcyclohexyl)aniline
CID 64751764

Frequently Asked Questions

What is the IUPAC name of 2-(ethoxymethyl)-N-(3-methylcyclopentyl)aniline?
The IUPAC name of 2-(ethoxymethyl)-N-(3-methylcyclopentyl)aniline (CID 64500672) is 2-(ethoxymethyl)-N-(3-methylcyclopentyl)aniline.
What is the SMILES notation for 2-(ethoxymethyl)-N-(3-methylcyclopentyl)aniline?
The canonical SMILES for 2-(ethoxymethyl)-N-(3-methylcyclopentyl)aniline is CCOCc1ccccc1NC1CCC(C)C1.
What is the InChIKey of 2-(ethoxymethyl)-N-(3-methylcyclopentyl)aniline?
The InChIKey is QWIBKALYNBFHIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-3-17-11-13-6-4-5-7-15(13)16-14-9-8-12(2)10-14/h4-7,12,14,16H,3,8-11H2,1-2H3.
What are the key properties of 2-(ethoxymethyl)-N-(3-methylcyclopentyl)aniline?
2-(ethoxymethyl)-N-(3-methylcyclopentyl)aniline has a molecular weight of 233.35 g/mol, XLogP of 3.82, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethoxymethyl)-N-(3-methylcyclopentyl)aniline is sourced from PubChem (CID 64500672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).