N-[[2-(aminomethyl)cyclopentyl]methyl]-2-ethoxy-N-(2-ethoxyethyl)ethanamine

C15H32N2O2 — CID 82953790

IUPACN-[[2-(aminomethyl)cyclopentyl]methyl]-2-ethoxy-N-(2-ethoxyethyl)ethanamine
SMILESCCOCCN(CCOCC)CC1CCCC1CN
InChIInChI=1S/C15H32N2O2/c1-3-18-10-8-17(9-11-19-4-2)13-15-7-5-6-14(15)12-16/h14-15H,3-13,16H2,1-2H3
InChIKeyMOSLWDNHZXATQF-UHFFFAOYSA-N
MW272.43 g/mol
LogP1.74
Rot. Bonds11

About N-[[2-(aminomethyl)cyclopentyl]methyl]-2-ethoxy-N-(2-ethoxyethyl)ethanamine

N-[[2-(aminomethyl)cyclopentyl]methyl]-2-ethoxy-N-(2-ethoxyethyl)ethanamine (PubChem CID 82953790) has the molecular formula C15H32N2O2 and a molecular weight of 272.43 g/mol. Its IUPAC name is N-[[2-(aminomethyl)cyclopentyl]methyl]-2-ethoxy-N-(2-ethoxyethyl)ethanamine.

Molecular Properties

Compound NameN-[[2-(aminomethyl)cyclopentyl]methyl]-2-ethoxy-N-(2-ethoxyethyl)ethanamine
PubChem CID82953790
Molecular FormulaC15H32N2O2
Molecular Weight272.43 g/mol
Exact Mass272.25
IUPAC NameN-[[2-(aminomethyl)cyclopentyl]methyl]-2-ethoxy-N-(2-ethoxyethyl)ethanamine
SMILESCCOCCN(CCOCC)CC1CCCC1CN
InChIInChI=1S/C15H32N2O2/c1-3-18-10-8-17(9-11-19-4-2)13-15-7-5-6-14(15)12-16/h14-15H,3-13,16H2,1-2H3
InChIKeyMOSLWDNHZXATQF-UHFFFAOYSA-N
XLogP1.74
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.43
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[[2-(aminomethyl)cyclopentyl]methyl]-2-ethoxy-N-(2-ethoxyethyl)ethanamine?
The IUPAC name of N-[[2-(aminomethyl)cyclopentyl]methyl]-2-ethoxy-N-(2-ethoxyethyl)ethanamine (CID 82953790) is N-[[2-(aminomethyl)cyclopentyl]methyl]-2-ethoxy-N-(2-ethoxyethyl)ethanamine.
What is the SMILES notation for N-[[2-(aminomethyl)cyclopentyl]methyl]-2-ethoxy-N-(2-ethoxyethyl)ethanamine?
The canonical SMILES for N-[[2-(aminomethyl)cyclopentyl]methyl]-2-ethoxy-N-(2-ethoxyethyl)ethanamine is CCOCCN(CCOCC)CC1CCCC1CN.
What is the InChIKey of N-[[2-(aminomethyl)cyclopentyl]methyl]-2-ethoxy-N-(2-ethoxyethyl)ethanamine?
The InChIKey is MOSLWDNHZXATQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O2/c1-3-18-10-8-17(9-11-19-4-2)13-15-7-5-6-14(15)12-16/h14-15H,3-13,16H2,1-2H3.
What are the key properties of N-[[2-(aminomethyl)cyclopentyl]methyl]-2-ethoxy-N-(2-ethoxyethyl)ethanamine?
N-[[2-(aminomethyl)cyclopentyl]methyl]-2-ethoxy-N-(2-ethoxyethyl)ethanamine has a molecular weight of 272.43 g/mol, XLogP of 1.74, 11 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(aminomethyl)cyclopentyl]methyl]-2-ethoxy-N-(2-ethoxyethyl)ethanamine is sourced from PubChem (CID 82953790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).