3-[(1-ethoxypropan-2-ylamino)methyl]cyclopentan-1-ol

C11H23NO2 — CID 103271450

IUPAC3-[(1-ethoxypropan-2-ylamino)methyl]cyclopentan-1-ol
SMILESCCOCC(C)NCC1CCC(O)C1
InChIInChI=1S/C11H23NO2/c1-3-14-8-9(2)12-7-10-4-5-11(13)6-10/h9-13H,3-8H2,1-2H3
InChIKeyIHBOXGFACBHVHP-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.16
Rot. Bonds6

About 3-[(1-ethoxypropan-2-ylamino)methyl]cyclopentan-1-ol

3-[(1-ethoxypropan-2-ylamino)methyl]cyclopentan-1-ol (PubChem CID 103271450) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is 3-[(1-ethoxypropan-2-ylamino)methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name3-[(1-ethoxypropan-2-ylamino)methyl]cyclopentan-1-ol
PubChem CID103271450
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Name3-[(1-ethoxypropan-2-ylamino)methyl]cyclopentan-1-ol
SMILESCCOCC(C)NCC1CCC(O)C1
InChIInChI=1S/C11H23NO2/c1-3-14-8-9(2)12-7-10-4-5-11(13)6-10/h9-13H,3-8H2,1-2H3
InChIKeyIHBOXGFACBHVHP-UHFFFAOYSA-N
XLogP1.16
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(pentan-2-ylamino)methyl]cyclopentan-1-ol
CID 103271338
3-[(1-cyclopropylpropan-2-ylamino)methyl]cyclopentan-1-ol
CID 103271439
4-[(1-ethoxypropan-2-ylamino)methyl]cyclohexane-1-carboxylic acid
CID 104964102
3-[[(4-methoxy-4-methylpentan-2-yl)amino]methyl]cyclopentan-1-ol
CID 103271409
3-[(pentan-3-ylamino)methyl]cyclopentan-1-ol
CID 103271506
3-[(1,1-dimethoxypropan-2-ylamino)methyl]cyclopentan-1-ol
CID 106121090
4-[(4-methylpentan-2-ylamino)methyl]cyclohexan-1-ol
CID 106126383
3-[(but-3-yn-2-ylamino)methyl]cyclopentan-1-ol
CID 106129449
1-ethoxy-N-[(2-propan-2-yloxolan-3-yl)methyl]propan-2-amine
CID 115726718
3-[(2-methylpropylamino)methyl]cyclopentan-1-ol
CID 103270977
N-[(5,5-dimethyloxolan-2-yl)methyl]-1-ethoxypropan-2-amine
CID 116521359
N-[3-(cyclopropylmethoxy)propyl]-1-ethoxypropan-2-amine
CID 115707824

Frequently Asked Questions

What is the IUPAC name of 3-[(1-ethoxypropan-2-ylamino)methyl]cyclopentan-1-ol?
The IUPAC name of 3-[(1-ethoxypropan-2-ylamino)methyl]cyclopentan-1-ol (CID 103271450) is 3-[(1-ethoxypropan-2-ylamino)methyl]cyclopentan-1-ol.
What is the SMILES notation for 3-[(1-ethoxypropan-2-ylamino)methyl]cyclopentan-1-ol?
The canonical SMILES for 3-[(1-ethoxypropan-2-ylamino)methyl]cyclopentan-1-ol is CCOCC(C)NCC1CCC(O)C1.
What is the InChIKey of 3-[(1-ethoxypropan-2-ylamino)methyl]cyclopentan-1-ol?
The InChIKey is IHBOXGFACBHVHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-3-14-8-9(2)12-7-10-4-5-11(13)6-10/h9-13H,3-8H2,1-2H3.
What are the key properties of 3-[(1-ethoxypropan-2-ylamino)methyl]cyclopentan-1-ol?
3-[(1-ethoxypropan-2-ylamino)methyl]cyclopentan-1-ol has a molecular weight of 201.31 g/mol, XLogP of 1.16, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(1-ethoxypropan-2-ylamino)methyl]cyclopentan-1-ol is sourced from PubChem (CID 103271450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).