[2-[2-[1-methoxypropan-2-yl(methyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol

C16H34N2O2 — CID 79570962

IUPAC[2-[2-[1-methoxypropan-2-yl(methyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol
SMILESCCCNC1(CO)CCCC1CCN(C)C(C)COC
InChIInChI=1S/C16H34N2O2/c1-5-10-17-16(13-19)9-6-7-15(16)8-11-18(3)14(2)12-20-4/h14-15,17,19H,5-13H2,1-4H3
InChIKeyMBDJXJKVJSUEFP-UHFFFAOYSA-N
MW286.46 g/mol
LogP1.87
Rot. Bonds10

About [2-[2-[1-methoxypropan-2-yl(methyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol

[2-[2-[1-methoxypropan-2-yl(methyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol (PubChem CID 79570962) has the molecular formula C16H34N2O2 and a molecular weight of 286.46 g/mol. Its IUPAC name is [2-[2-[1-methoxypropan-2-yl(methyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol.

Molecular Properties

Compound Name[2-[2-[1-methoxypropan-2-yl(methyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol
PubChem CID79570962
Molecular FormulaC16H34N2O2
Molecular Weight286.46 g/mol
Exact Mass286.26
IUPAC Name[2-[2-[1-methoxypropan-2-yl(methyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol
SMILESCCCNC1(CO)CCCC1CCN(C)C(C)COC
InChIInChI=1S/C16H34N2O2/c1-5-10-17-16(13-19)9-6-7-15(16)8-11-18(3)14(2)12-20-4/h14-15,17,19H,5-13H2,1-4H3
InChIKeyMBDJXJKVJSUEFP-UHFFFAOYSA-N
XLogP1.87
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.46
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[2-[2-[3,3-dimethylbutan-2-yl(methyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol
CID 79567623
[2-(2-propoxyethyl)-1-(propylamino)cyclopentyl]methanol
CID 79581095
[2-[2-(3-methylbutoxy)ethyl]-1-(propylamino)cyclopentyl]methanol
CID 79581996
[2-[2-[methyl(2-methylpropyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol
CID 79571507
[2-[2-[ethyl(methyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol
CID 79571443
[2-[2-[methyl(oxan-4-yl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol
CID 79568301
[2-[2-[3,3-dimethylbutan-2-yl(methyl)amino]ethyl]-1-(ethylamino)cyclopentyl]methanol
CID 79571170
[1-(ethylamino)-2-[2-(2-methoxyethoxy)ethyl]cyclopentyl]methanol
CID 79581609
[1-(cyclopropylamino)-2-[2-[methyl(propan-2-yl)amino]ethyl]cyclopentyl]methanol
CID 79571439
2-[2-[methyl(propan-2-yl)amino]ethyl]-1-(propylamino)cyclopentane-1-carboxylic acid
CID 79577889
2-[2-[1-methoxypropan-2-yl(methyl)amino]ethyl]-1-(propan-2-ylamino)cyclopentane-1-carboxamide
CID 79565645
[2-[2-(3-methoxypropoxy)ethyl]-1-(propan-2-ylamino)cyclopentyl]methanol
CID 79580993

Frequently Asked Questions

What is the IUPAC name of [2-[2-[1-methoxypropan-2-yl(methyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol?
The IUPAC name of [2-[2-[1-methoxypropan-2-yl(methyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol (CID 79570962) is [2-[2-[1-methoxypropan-2-yl(methyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol.
What is the SMILES notation for [2-[2-[1-methoxypropan-2-yl(methyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol?
The canonical SMILES for [2-[2-[1-methoxypropan-2-yl(methyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol is CCCNC1(CO)CCCC1CCN(C)C(C)COC.
What is the InChIKey of [2-[2-[1-methoxypropan-2-yl(methyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol?
The InChIKey is MBDJXJKVJSUEFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2O2/c1-5-10-17-16(13-19)9-6-7-15(16)8-11-18(3)14(2)12-20-4/h14-15,17,19H,5-13H2,1-4H3.
What are the key properties of [2-[2-[1-methoxypropan-2-yl(methyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol?
[2-[2-[1-methoxypropan-2-yl(methyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol has a molecular weight of 286.46 g/mol, XLogP of 1.87, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[2-[1-methoxypropan-2-yl(methyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol is sourced from PubChem (CID 79570962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).