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

C16H34N2O — CID 79571507

IUPAC[2-[2-[methyl(2-methylpropyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol
SMILESCCCNC1(CO)CCCC1CCN(C)CC(C)C
InChIInChI=1S/C16H34N2O/c1-5-10-17-16(13-19)9-6-7-15(16)8-11-18(4)12-14(2)3/h14-15,17,19H,5-13H2,1-4H3
InChIKeyKLIYYSGMIAKJKC-UHFFFAOYSA-N
MW270.46 g/mol
LogP2.50
Rot. Bonds9

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

[2-[2-[methyl(2-methylpropyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol (PubChem CID 79571507) has the molecular formula C16H34N2O and a molecular weight of 270.46 g/mol. Its IUPAC name is [2-[2-[methyl(2-methylpropyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol.

Molecular Properties

Compound Name[2-[2-[methyl(2-methylpropyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol
PubChem CID79571507
Molecular FormulaC16H34N2O
Molecular Weight270.46 g/mol
Exact Mass270.27
IUPAC Name[2-[2-[methyl(2-methylpropyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol
SMILESCCCNC1(CO)CCCC1CCN(C)CC(C)C
InChIInChI=1S/C16H34N2O/c1-5-10-17-16(13-19)9-6-7-15(16)8-11-18(4)12-14(2)3/h14-15,17,19H,5-13H2,1-4H3
InChIKeyKLIYYSGMIAKJKC-UHFFFAOYSA-N
XLogP2.50
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.46
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[2-[2-[ethyl(methyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol
CID 79571443
[2-[2-[3,3-dimethylbutan-2-yl(methyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol
CID 79567623
[2-[2-(3-methylbutoxy)ethyl]-1-(propylamino)cyclopentyl]methanol
CID 79581996
[2-[2-[1-methoxypropan-2-yl(methyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol
CID 79570962
[2-[2-[methyl(2-methylbutyl)amino]ethyl]-1-(propan-2-ylamino)cyclopentyl]methanol
CID 79571377
[2-[2-[methyl(oxan-4-yl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol
CID 79568301
[2-(2-propoxyethyl)-1-(propylamino)cyclopentyl]methanol
CID 79581095
[2-[2-[ethyl(2-methylpropyl)amino]ethyl]-1-(methylamino)cyclopentyl]methanol
CID 79571940
[2-[2-[(2S,6R)-2,6-dimethylpiperidin-1-yl]ethyl]-1-(propylamino)cyclopentyl]methanol
CID 104968989
[2-[2-[cyclohexylmethyl(methyl)amino]ethyl]-1-(ethylamino)cyclopentyl]methanol
CID 79567645
[2-(2-cyclohexylsulfanylethyl)-1-(propylamino)cyclopentyl]methanol
CID 79580959
[2-[2-[methyl-[(2-methylcyclopropyl)methyl]amino]ethyl]-1-(propan-2-ylamino)cyclopentyl]methanol
CID 79571345

Frequently Asked Questions

What is the IUPAC name of [2-[2-[methyl(2-methylpropyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol?
The IUPAC name of [2-[2-[methyl(2-methylpropyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol (CID 79571507) is [2-[2-[methyl(2-methylpropyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol.
What is the SMILES notation for [2-[2-[methyl(2-methylpropyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol?
The canonical SMILES for [2-[2-[methyl(2-methylpropyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol is CCCNC1(CO)CCCC1CCN(C)CC(C)C.
What is the InChIKey of [2-[2-[methyl(2-methylpropyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol?
The InChIKey is KLIYYSGMIAKJKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2O/c1-5-10-17-16(13-19)9-6-7-15(16)8-11-18(4)12-14(2)3/h14-15,17,19H,5-13H2,1-4H3.
What are the key properties of [2-[2-[methyl(2-methylpropyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol?
[2-[2-[methyl(2-methylpropyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol has a molecular weight of 270.46 g/mol, XLogP of 2.50, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[2-[methyl(2-methylpropyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol is sourced from PubChem (CID 79571507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).