[1-(methylamino)-2-[2-(oxolan-3-yloxy)ethyl]cyclopentyl]methanol

C13H25NO3 — CID 79580990

IUPAC[1-(methylamino)-2-[2-(oxolan-3-yloxy)ethyl]cyclopentyl]methanol
SMILESCNC1(CO)CCCC1CCOC1CCOC1
InChIInChI=1S/C13H25NO3/c1-14-13(10-15)6-2-3-11(13)4-8-17-12-5-7-16-9-12/h11-12,14-15H,2-10H2,1H3
InChIKeyHQABQPPJNKYXND-UHFFFAOYSA-N
MW243.35 g/mol
LogP0.93
Rot. Bonds6

About [1-(methylamino)-2-[2-(oxolan-3-yloxy)ethyl]cyclopentyl]methanol

[1-(methylamino)-2-[2-(oxolan-3-yloxy)ethyl]cyclopentyl]methanol (PubChem CID 79580990) has the molecular formula C13H25NO3 and a molecular weight of 243.35 g/mol. Its IUPAC name is [1-(methylamino)-2-[2-(oxolan-3-yloxy)ethyl]cyclopentyl]methanol.

Molecular Properties

Compound Name[1-(methylamino)-2-[2-(oxolan-3-yloxy)ethyl]cyclopentyl]methanol
PubChem CID79580990
Molecular FormulaC13H25NO3
Molecular Weight243.35 g/mol
Exact Mass243.18
IUPAC Name[1-(methylamino)-2-[2-(oxolan-3-yloxy)ethyl]cyclopentyl]methanol
SMILESCNC1(CO)CCCC1CCOC1CCOC1
InChIInChI=1S/C13H25NO3/c1-14-13(10-15)6-2-3-11(13)4-8-17-12-5-7-16-9-12/h11-12,14-15H,2-10H2,1H3
InChIKeyHQABQPPJNKYXND-UHFFFAOYSA-N
XLogP0.93
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [1-(methylamino)-2-[2-(oxolan-3-yloxy)ethyl]cyclopentyl]methanol?
The IUPAC name of [1-(methylamino)-2-[2-(oxolan-3-yloxy)ethyl]cyclopentyl]methanol (CID 79580990) is [1-(methylamino)-2-[2-(oxolan-3-yloxy)ethyl]cyclopentyl]methanol.
What is the SMILES notation for [1-(methylamino)-2-[2-(oxolan-3-yloxy)ethyl]cyclopentyl]methanol?
The canonical SMILES for [1-(methylamino)-2-[2-(oxolan-3-yloxy)ethyl]cyclopentyl]methanol is CNC1(CO)CCCC1CCOC1CCOC1.
What is the InChIKey of [1-(methylamino)-2-[2-(oxolan-3-yloxy)ethyl]cyclopentyl]methanol?
The InChIKey is HQABQPPJNKYXND-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO3/c1-14-13(10-15)6-2-3-11(13)4-8-17-12-5-7-16-9-12/h11-12,14-15H,2-10H2,1H3.
What are the key properties of [1-(methylamino)-2-[2-(oxolan-3-yloxy)ethyl]cyclopentyl]methanol?
[1-(methylamino)-2-[2-(oxolan-3-yloxy)ethyl]cyclopentyl]methanol has a molecular weight of 243.35 g/mol, XLogP of 0.93, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(methylamino)-2-[2-(oxolan-3-yloxy)ethyl]cyclopentyl]methanol is sourced from PubChem (CID 79580990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).