[2-[2-[methyl(oxan-4-yl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol

C17H34N2O2 — CID 79568301

IUPAC[2-[2-[methyl(oxan-4-yl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol
SMILESCCCNC1(CO)CCCC1CCN(C)C1CCOCC1
InChIInChI=1S/C17H34N2O2/c1-3-10-18-17(14-20)9-4-5-15(17)6-11-19(2)16-7-12-21-13-8-16/h15-16,18,20H,3-14H2,1-2H3
InChIKeyBMVOMUMCJTWPFN-UHFFFAOYSA-N
MW298.47 g/mol
LogP2.02
Rot. Bonds8

About [2-[2-[methyl(oxan-4-yl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol

[2-[2-[methyl(oxan-4-yl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol (PubChem CID 79568301) has the molecular formula C17H34N2O2 and a molecular weight of 298.47 g/mol. Its IUPAC name is [2-[2-[methyl(oxan-4-yl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol.

Molecular Properties

Compound Name[2-[2-[methyl(oxan-4-yl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol
PubChem CID79568301
Molecular FormulaC17H34N2O2
Molecular Weight298.47 g/mol
Exact Mass298.26
IUPAC Name[2-[2-[methyl(oxan-4-yl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol
SMILESCCCNC1(CO)CCCC1CCN(C)C1CCOCC1
InChIInChI=1S/C17H34N2O2/c1-3-10-18-17(14-20)9-4-5-15(17)6-11-19(2)16-7-12-21-13-8-16/h15-16,18,20H,3-14H2,1-2H3
InChIKeyBMVOMUMCJTWPFN-UHFFFAOYSA-N
XLogP2.02
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.47
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze [2-[2-[methyl(oxan-4-yl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol with MolForge

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Related Compounds

[1-(cyclopropylamino)-2-[2-[methyl(oxan-4-yl)amino]ethyl]cyclopentyl]methanol
CID 79568172
[2-[2-[ethyl(methyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol
CID 79571443
[2-[2-[methyl(2-methylpropyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol
CID 79571507
[1-amino-2-[2-[methyl(oxan-4-yl)amino]ethyl]cyclopentyl]methanol
CID 79571590
[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-[1-methoxypropan-2-yl(methyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol
CID 79570962
[2-[2-[(2S,6R)-2,6-dimethylpiperidin-1-yl]ethyl]-1-(propylamino)cyclopentyl]methanol
CID 104968989
[2-[2-[(1,1-dioxothiolan-3-yl)-methylamino]ethyl]-1-(ethylamino)cyclopentyl]methanol
CID 79566538
[2-[2-(3-ethylmorpholin-4-yl)ethyl]-1-(propylamino)cyclopentyl]methanol
CID 79566405
1-(aminomethyl)-2-[2-[methyl(oxan-4-yl)amino]ethyl]cyclopentan-1-ol
CID 79586662
[2-(2-cyclohexylsulfanylethyl)-1-(propylamino)cyclopentyl]methanol
CID 79580959

Frequently Asked Questions

What is the IUPAC name of [2-[2-[methyl(oxan-4-yl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol?
The IUPAC name of [2-[2-[methyl(oxan-4-yl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol (CID 79568301) is [2-[2-[methyl(oxan-4-yl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol.
What is the SMILES notation for [2-[2-[methyl(oxan-4-yl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol?
The canonical SMILES for [2-[2-[methyl(oxan-4-yl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol is CCCNC1(CO)CCCC1CCN(C)C1CCOCC1.
What is the InChIKey of [2-[2-[methyl(oxan-4-yl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol?
The InChIKey is BMVOMUMCJTWPFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O2/c1-3-10-18-17(14-20)9-4-5-15(17)6-11-19(2)16-7-12-21-13-8-16/h15-16,18,20H,3-14H2,1-2H3.
What are the key properties of [2-[2-[methyl(oxan-4-yl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol?
[2-[2-[methyl(oxan-4-yl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol has a molecular weight of 298.47 g/mol, XLogP of 2.02, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[2-[methyl(oxan-4-yl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol is sourced from PubChem (CID 79568301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).