N-ethyl-2-[2-[2-(3-methoxypropoxy)ethoxy]ethyl]cyclopentan-1-amine

C15H31NO3 — CID 103177135

IUPACN-ethyl-2-[2-[2-(3-methoxypropoxy)ethoxy]ethyl]cyclopentan-1-amine
SMILESCCNC1CCCC1CCOCCOCCCOC
InChIInChI=1S/C15H31NO3/c1-3-16-15-7-4-6-14(15)8-11-19-13-12-18-10-5-9-17-2/h14-16H,3-13H2,1-2H3
InChIKeyHAYNPQAMABORNK-UHFFFAOYSA-N
MW273.42 g/mol
LogP2.22
Rot. Bonds12

About N-ethyl-2-[2-[2-(3-methoxypropoxy)ethoxy]ethyl]cyclopentan-1-amine

N-ethyl-2-[2-[2-(3-methoxypropoxy)ethoxy]ethyl]cyclopentan-1-amine (PubChem CID 103177135) has the molecular formula C15H31NO3 and a molecular weight of 273.42 g/mol. Its IUPAC name is N-ethyl-2-[2-[2-(3-methoxypropoxy)ethoxy]ethyl]cyclopentan-1-amine.

Molecular Properties

Compound NameN-ethyl-2-[2-[2-(3-methoxypropoxy)ethoxy]ethyl]cyclopentan-1-amine
PubChem CID103177135
Molecular FormulaC15H31NO3
Molecular Weight273.42 g/mol
Exact Mass273.23
IUPAC NameN-ethyl-2-[2-[2-(3-methoxypropoxy)ethoxy]ethyl]cyclopentan-1-amine
SMILESCCNC1CCCC1CCOCCOCCCOC
InChIInChI=1S/C15H31NO3/c1-3-16-15-7-4-6-14(15)8-11-19-13-12-18-10-5-9-17-2/h14-16H,3-13H2,1-2H3
InChIKeyHAYNPQAMABORNK-UHFFFAOYSA-N
XLogP2.22
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.42
LogP ≤ 52.22
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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Related Compounds

2-[2-(2-butoxyethoxy)ethyl]-N-ethylcyclopentan-1-amine
CID 79572805
2-[2-(3-methoxypropoxy)ethyl]-N-methylcyclohexan-1-amine
CID 103181114
N-ethyl-2-[2-(2,2,2-trifluoroethoxy)ethyl]cyclohexan-1-amine
CID 54962222
2-[2-[bis(2-methoxyethyl)amino]ethyl]-N-ethylcyclopentan-1-amine
CID 79565195
2-[2-(2-propoxyethoxy)ethyl]-N-propylcyclopentan-1-amine
CID 79573655
trans-(1R,2S)-N-ethyl-2-propylcyclopentan-1-amine
CID 11665449
N-ethyl-2-[[2-methoxyethyl(3-methoxypropyl)amino]methyl]cyclohexan-1-amine
CID 62614429
2-[2-[butan-2-yl(2-methoxyethyl)amino]ethyl]-N-ethylcyclopentan-1-amine
CID 79565993
2-[2-(2-cyclobutylethoxy)ethyl]-N-propylcyclopentan-1-amine
CID 106200997
2-(2-butan-2-yloxyethyl)-N-ethylcyclopentan-1-amine
CID 79572814
N-ethyl-3-[3-(2-methoxyethoxy)propyl]oxan-4-amine
CID 106469345
N-ethyl-2-octylcyclopentan-1-amine
CID 63399748

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[2-[2-(3-methoxypropoxy)ethoxy]ethyl]cyclopentan-1-amine?
The IUPAC name of N-ethyl-2-[2-[2-(3-methoxypropoxy)ethoxy]ethyl]cyclopentan-1-amine (CID 103177135) is N-ethyl-2-[2-[2-(3-methoxypropoxy)ethoxy]ethyl]cyclopentan-1-amine.
What is the SMILES notation for N-ethyl-2-[2-[2-(3-methoxypropoxy)ethoxy]ethyl]cyclopentan-1-amine?
The canonical SMILES for N-ethyl-2-[2-[2-(3-methoxypropoxy)ethoxy]ethyl]cyclopentan-1-amine is CCNC1CCCC1CCOCCOCCCOC.
What is the InChIKey of N-ethyl-2-[2-[2-(3-methoxypropoxy)ethoxy]ethyl]cyclopentan-1-amine?
The InChIKey is HAYNPQAMABORNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31NO3/c1-3-16-15-7-4-6-14(15)8-11-19-13-12-18-10-5-9-17-2/h14-16H,3-13H2,1-2H3.
What are the key properties of N-ethyl-2-[2-[2-(3-methoxypropoxy)ethoxy]ethyl]cyclopentan-1-amine?
N-ethyl-2-[2-[2-(3-methoxypropoxy)ethoxy]ethyl]cyclopentan-1-amine has a molecular weight of 273.42 g/mol, XLogP of 2.22, 12 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[2-[2-(3-methoxypropoxy)ethoxy]ethyl]cyclopentan-1-amine is sourced from PubChem (CID 103177135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).