N-(cyclopentylmethyl)-2-[2-(dimethylamino)ethoxy]ethanamine

C12H26N2O — CID 103952800

IUPACN-(cyclopentylmethyl)-2-[2-(dimethylamino)ethoxy]ethanamine
SMILESCN(C)CCOCCNCC1CCCC1
InChIInChI=1S/C12H26N2O/c1-14(2)8-10-15-9-7-13-11-12-5-3-4-6-12/h12-13H,3-11H2,1-2H3
InChIKeyFSHFMCRYBKTJGJ-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.34
Rot. Bonds8

About N-(cyclopentylmethyl)-2-[2-(dimethylamino)ethoxy]ethanamine

N-(cyclopentylmethyl)-2-[2-(dimethylamino)ethoxy]ethanamine (PubChem CID 103952800) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is N-(cyclopentylmethyl)-2-[2-(dimethylamino)ethoxy]ethanamine.

Molecular Properties

Compound NameN-(cyclopentylmethyl)-2-[2-(dimethylamino)ethoxy]ethanamine
PubChem CID103952800
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC NameN-(cyclopentylmethyl)-2-[2-(dimethylamino)ethoxy]ethanamine
SMILESCN(C)CCOCCNCC1CCCC1
InChIInChI=1S/C12H26N2O/c1-14(2)8-10-15-9-7-13-11-12-5-3-4-6-12/h12-13H,3-11H2,1-2H3
InChIKeyFSHFMCRYBKTJGJ-UHFFFAOYSA-N
XLogP1.34
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.34
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-(cyclopentylmethyl)-2-(2-propoxyethoxy)ethanamine
CID 63686610
N-(cyclopentylmethyl)-2-heptoxyethanamine
CID 62598497
N-(cyclohexylmethyl)-2-(3-methylbutoxy)ethanamine
CID 61483668
N-(cyclopentylmethyl)-2-(cyclopropylmethoxy)ethanamine
CID 62599762
N-[2-[2-(dimethylamino)ethoxy]ethyl]cyclohexanecarboxamide
CID 176960465
N-(cyclooctylmethyl)-N'-methyl-N'-propan-2-ylethane-1,2-diamine
CID 114207737
N-(2-butoxyethyl)-N'-(cyclopentylmethyl)-N'-methylethane-1,2-diamine
CID 55248291
4-[[2-(dimethylamino)ethylamino]methyl]cyclohexan-1-ol
CID 106133697
N'-(cyclohexylmethyl)-N-(cyclopropylmethyl)-N'-methylethane-1,2-diamine
CID 61447834
N-(dicyclopropylmethyl)-2-[2-(dimethylamino)ethoxy]ethanamine
CID 107094173
N-[2-[2-(dimethylamino)ethoxy]ethyl]propan-2-amine
CID 62341832
N'-(cyclopentylmethyl)-N-(2-ethoxyethyl)-N'-methylethane-1,2-diamine
CID 63655720

Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylmethyl)-2-[2-(dimethylamino)ethoxy]ethanamine?
The IUPAC name of N-(cyclopentylmethyl)-2-[2-(dimethylamino)ethoxy]ethanamine (CID 103952800) is N-(cyclopentylmethyl)-2-[2-(dimethylamino)ethoxy]ethanamine.
What is the SMILES notation for N-(cyclopentylmethyl)-2-[2-(dimethylamino)ethoxy]ethanamine?
The canonical SMILES for N-(cyclopentylmethyl)-2-[2-(dimethylamino)ethoxy]ethanamine is CN(C)CCOCCNCC1CCCC1.
What is the InChIKey of N-(cyclopentylmethyl)-2-[2-(dimethylamino)ethoxy]ethanamine?
The InChIKey is FSHFMCRYBKTJGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-14(2)8-10-15-9-7-13-11-12-5-3-4-6-12/h12-13H,3-11H2,1-2H3.
What are the key properties of N-(cyclopentylmethyl)-2-[2-(dimethylamino)ethoxy]ethanamine?
N-(cyclopentylmethyl)-2-[2-(dimethylamino)ethoxy]ethanamine has a molecular weight of 214.35 g/mol, XLogP of 1.34, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylmethyl)-2-[2-(dimethylamino)ethoxy]ethanamine is sourced from PubChem (CID 103952800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).