N-(2-cyclopentyloxyethyl)-3-methoxycyclobutan-1-amine

C12H23NO2 — CID 104871151

IUPACN-(2-cyclopentyloxyethyl)-3-methoxycyclobutan-1-amine
SMILESCOC1CC(NCCOC2CCCC2)C1
InChIInChI=1S/C12H23NO2/c1-14-12-8-10(9-12)13-6-7-15-11-4-2-3-5-11/h10-13H,2-9H2,1H3
InChIKeySSVZGVMYQPGEJS-UHFFFAOYSA-N
MW213.32 g/mol
LogP1.71
Rot. Bonds6

About N-(2-cyclopentyloxyethyl)-3-methoxycyclobutan-1-amine

N-(2-cyclopentyloxyethyl)-3-methoxycyclobutan-1-amine (PubChem CID 104871151) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is N-(2-cyclopentyloxyethyl)-3-methoxycyclobutan-1-amine.

Molecular Properties

Compound NameN-(2-cyclopentyloxyethyl)-3-methoxycyclobutan-1-amine
PubChem CID104871151
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC NameN-(2-cyclopentyloxyethyl)-3-methoxycyclobutan-1-amine
SMILESCOC1CC(NCCOC2CCCC2)C1
InChIInChI=1S/C12H23NO2/c1-14-12-8-10(9-12)13-6-7-15-11-4-2-3-5-11/h10-13H,2-9H2,1H3
InChIKeySSVZGVMYQPGEJS-UHFFFAOYSA-N
XLogP1.71
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(2-cyclohexyloxyethyl)cyclohexanamine
CID 62567044
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N-(2-cycloheptyloxyethyl)-3-methylcyclohexan-1-amine
CID 62585347
N-(2-cyclobutyloxyethyl)-4-methylcyclohexan-1-amine
CID 62584943
N-(2-cyclopentyloxyethyl)oxan-4-amine
CID 63099341
N-(2-cyclopentyloxyethyl)-3,3,5,5-tetramethylcyclohexan-1-amine
CID 112682122
N-(2-cyclopentyloxyethyl)-3-cyclopropylcyclohexan-1-amine
CID 64624006
N-(2-cyclopentyloxyethyl)-1,5-dimethylpyrrolidin-3-amine
CID 81332868
N-(2-cyclopentyloxyethyl)spiro[4.5]decan-8-amine
CID 114817665
N-(2-cyclopentyloxyethyl)-1-propan-2-ylpiperidin-4-amine
CID 63823696
N-(2-cyclohexyloxyethyl)-4-propylcyclohexan-1-amine
CID 63826755
3-(3-methoxycyclohexyl)oxy-N-propylcyclobutan-1-amine
CID 66351376

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopentyloxyethyl)-3-methoxycyclobutan-1-amine?
The IUPAC name of N-(2-cyclopentyloxyethyl)-3-methoxycyclobutan-1-amine (CID 104871151) is N-(2-cyclopentyloxyethyl)-3-methoxycyclobutan-1-amine.
What is the SMILES notation for N-(2-cyclopentyloxyethyl)-3-methoxycyclobutan-1-amine?
The canonical SMILES for N-(2-cyclopentyloxyethyl)-3-methoxycyclobutan-1-amine is COC1CC(NCCOC2CCCC2)C1.
What is the InChIKey of N-(2-cyclopentyloxyethyl)-3-methoxycyclobutan-1-amine?
The InChIKey is SSVZGVMYQPGEJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c1-14-12-8-10(9-12)13-6-7-15-11-4-2-3-5-11/h10-13H,2-9H2,1H3.
What are the key properties of N-(2-cyclopentyloxyethyl)-3-methoxycyclobutan-1-amine?
N-(2-cyclopentyloxyethyl)-3-methoxycyclobutan-1-amine has a molecular weight of 213.32 g/mol, XLogP of 1.71, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopentyloxyethyl)-3-methoxycyclobutan-1-amine is sourced from PubChem (CID 104871151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).