[3-[1-methoxypropan-2-yl(methyl)amino]-1-(propylamino)cyclopentyl]methanol

C14H30N2O2 — CID 79655810

IUPAC[3-[1-methoxypropan-2-yl(methyl)amino]-1-(propylamino)cyclopentyl]methanol
SMILESCCCNC1(CO)CCC(N(C)C(C)COC)C1
InChIInChI=1S/C14H30N2O2/c1-5-8-15-14(11-17)7-6-13(9-14)16(3)12(2)10-18-4/h12-13,15,17H,5-11H2,1-4H3
InChIKeyMFXWYPSFJVEMEL-UHFFFAOYSA-N
MW258.41 g/mol
LogP1.24
Rot. Bonds8

About [3-[1-methoxypropan-2-yl(methyl)amino]-1-(propylamino)cyclopentyl]methanol

[3-[1-methoxypropan-2-yl(methyl)amino]-1-(propylamino)cyclopentyl]methanol (PubChem CID 79655810) has the molecular formula C14H30N2O2 and a molecular weight of 258.41 g/mol. Its IUPAC name is [3-[1-methoxypropan-2-yl(methyl)amino]-1-(propylamino)cyclopentyl]methanol.

Molecular Properties

Compound Name[3-[1-methoxypropan-2-yl(methyl)amino]-1-(propylamino)cyclopentyl]methanol
PubChem CID79655810
Molecular FormulaC14H30N2O2
Molecular Weight258.41 g/mol
Exact Mass258.23
IUPAC Name[3-[1-methoxypropan-2-yl(methyl)amino]-1-(propylamino)cyclopentyl]methanol
SMILESCCCNC1(CO)CCC(N(C)C(C)COC)C1
InChIInChI=1S/C14H30N2O2/c1-5-8-15-14(11-17)7-6-13(9-14)16(3)12(2)10-18-4/h12-13,15,17H,5-11H2,1-4H3
InChIKeyMFXWYPSFJVEMEL-UHFFFAOYSA-N
XLogP1.24
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[3-[methyl(4-methylpentan-2-yl)amino]-1-(propylamino)cyclopentyl]methanol
CID 79656145
[1-(cyclopropylamino)-3-[1-methoxypropan-2-yl(methyl)amino]cyclopentyl]methanol
CID 79655891
[3-[methyl(2-propan-2-yloxyethyl)amino]-1-(propylamino)cyclohexyl]methanol
CID 81065200
[1-(methylamino)-3-[methyl(pentan-2-yl)amino]cyclopentyl]methanol
CID 79656781
[3-[methyl(oxan-4-yl)amino]-1-(propylamino)cyclopentyl]methanol
CID 79655803
[3-[cyclopropylmethyl(ethyl)amino]-1-(propylamino)cyclopentyl]methanol
CID 79656262
[3-(4-methylpentoxy)-1-(propylamino)cyclopentyl]methanol
CID 79646271
1-(ethylamino)-3-[1-methoxypropan-2-yl(methyl)amino]cyclopentane-1-carbonitrile
CID 79639856
[1-(ethylamino)-3-[methyl(pentan-2-yl)amino]cyclohexyl]methanol
CID 79640702
[3-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]-1-(propylamino)cyclopentyl]methanol
CID 79647008
[3-[cyclohexyl(methyl)amino]-1-(propylamino)cyclohexyl]methanol
CID 79635204
[1-(propylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]cyclopentyl]methanol
CID 79656540

Frequently Asked Questions

What is the IUPAC name of [3-[1-methoxypropan-2-yl(methyl)amino]-1-(propylamino)cyclopentyl]methanol?
The IUPAC name of [3-[1-methoxypropan-2-yl(methyl)amino]-1-(propylamino)cyclopentyl]methanol (CID 79655810) is [3-[1-methoxypropan-2-yl(methyl)amino]-1-(propylamino)cyclopentyl]methanol.
What is the SMILES notation for [3-[1-methoxypropan-2-yl(methyl)amino]-1-(propylamino)cyclopentyl]methanol?
The canonical SMILES for [3-[1-methoxypropan-2-yl(methyl)amino]-1-(propylamino)cyclopentyl]methanol is CCCNC1(CO)CCC(N(C)C(C)COC)C1.
What is the InChIKey of [3-[1-methoxypropan-2-yl(methyl)amino]-1-(propylamino)cyclopentyl]methanol?
The InChIKey is MFXWYPSFJVEMEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O2/c1-5-8-15-14(11-17)7-6-13(9-14)16(3)12(2)10-18-4/h12-13,15,17H,5-11H2,1-4H3.
What are the key properties of [3-[1-methoxypropan-2-yl(methyl)amino]-1-(propylamino)cyclopentyl]methanol?
[3-[1-methoxypropan-2-yl(methyl)amino]-1-(propylamino)cyclopentyl]methanol has a molecular weight of 258.41 g/mol, XLogP of 1.24, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[1-methoxypropan-2-yl(methyl)amino]-1-(propylamino)cyclopentyl]methanol is sourced from PubChem (CID 79655810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).