[2-[(2-propoxyethylamino)methyl]cyclopentyl]methanol

C12H25NO2 — CID 106452162

IUPAC[2-[(2-propoxyethylamino)methyl]cyclopentyl]methanol
SMILESCCCOCCNCC1CCCC1CO
InChIInChI=1S/C12H25NO2/c1-2-7-15-8-6-13-9-11-4-3-5-12(11)10-14/h11-14H,2-10H2,1H3
InChIKeyIPMSVHBDXQHBDL-UHFFFAOYSA-N
MW215.34 g/mol
LogP1.41
Rot. Bonds8

About [2-[(2-propoxyethylamino)methyl]cyclopentyl]methanol

[2-[(2-propoxyethylamino)methyl]cyclopentyl]methanol (PubChem CID 106452162) has the molecular formula C12H25NO2 and a molecular weight of 215.34 g/mol. Its IUPAC name is [2-[(2-propoxyethylamino)methyl]cyclopentyl]methanol.

Molecular Properties

Compound Name[2-[(2-propoxyethylamino)methyl]cyclopentyl]methanol
PubChem CID106452162
Molecular FormulaC12H25NO2
Molecular Weight215.34 g/mol
Exact Mass215.19
IUPAC Name[2-[(2-propoxyethylamino)methyl]cyclopentyl]methanol
SMILESCCCOCCNCC1CCCC1CO
InChIInChI=1S/C12H25NO2/c1-2-7-15-8-6-13-9-11-4-3-5-12(11)10-14/h11-14H,2-10H2,1H3
InChIKeyIPMSVHBDXQHBDL-UHFFFAOYSA-N
XLogP1.41
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 51.41
H-Bond Donors ≤ 52
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
[2-[(2-methylidenebutylamino)methyl]cyclopentyl]methanol
CID 66046903
N-[2-[[2-(hydroxymethyl)cyclopentyl]methylamino]ethyl]acetamide
CID 107529594
N-[(1,1-dioxothiolan-2-yl)methyl]-2-propoxyethanamine
CID 106452257
N-(oxan-3-ylmethyl)-2-propoxyethanamine
CID 106451725
N-(cyclopentylmethyl)-2-heptoxyethanamine
CID 62598497
N-[[2-(2-methylprop-2-enyl)cyclopentyl]methyl]propan-1-amine
CID 81032712
N-[[2-(propoxymethyl)cycloheptyl]methyl]ethanamine
CID 81025294
[2-[(4-methylpentylamino)methyl]cyclohexyl]methanol
CID 83156139
2-(4-propoxybutoxy)-N-[2-(4-propoxybutoxy)ethyl]ethanamine
CID 87914124
2-butoxy-N-[(4-methylcyclohexyl)methyl]ethanamine
CID 63243752
N-[[2-(chloromethyl)cyclohexyl]methyl]-2-(3-methoxypropoxy)ethanamine
CID 103183994

Frequently Asked Questions

What is the IUPAC name of [2-[(2-propoxyethylamino)methyl]cyclopentyl]methanol?
The IUPAC name of [2-[(2-propoxyethylamino)methyl]cyclopentyl]methanol (CID 106452162) is [2-[(2-propoxyethylamino)methyl]cyclopentyl]methanol.
What is the SMILES notation for [2-[(2-propoxyethylamino)methyl]cyclopentyl]methanol?
The canonical SMILES for [2-[(2-propoxyethylamino)methyl]cyclopentyl]methanol is CCCOCCNCC1CCCC1CO.
What is the InChIKey of [2-[(2-propoxyethylamino)methyl]cyclopentyl]methanol?
The InChIKey is IPMSVHBDXQHBDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO2/c1-2-7-15-8-6-13-9-11-4-3-5-12(11)10-14/h11-14H,2-10H2,1H3.
What are the key properties of [2-[(2-propoxyethylamino)methyl]cyclopentyl]methanol?
[2-[(2-propoxyethylamino)methyl]cyclopentyl]methanol has a molecular weight of 215.34 g/mol, XLogP of 1.41, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(2-propoxyethylamino)methyl]cyclopentyl]methanol is sourced from PubChem (CID 106452162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).