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

C14H28N2O2 — CID 79655891

IUPAC[1-(cyclopropylamino)-3-[1-methoxypropan-2-yl(methyl)amino]cyclopentyl]methanol
SMILESCOCC(C)N(C)C1CCC(CO)(NC2CC2)C1
InChIInChI=1S/C14H28N2O2/c1-11(9-18-3)16(2)13-6-7-14(8-13,10-17)15-12-4-5-12/h11-13,15,17H,4-10H2,1-3H3
InChIKeyUPNUHUOKWIHAAB-UHFFFAOYSA-N
MW256.39 g/mol
LogP0.99
Rot. Bonds7

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

[1-(cyclopropylamino)-3-[1-methoxypropan-2-yl(methyl)amino]cyclopentyl]methanol (PubChem CID 79655891) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is [1-(cyclopropylamino)-3-[1-methoxypropan-2-yl(methyl)amino]cyclopentyl]methanol.

Molecular Properties

Compound Name[1-(cyclopropylamino)-3-[1-methoxypropan-2-yl(methyl)amino]cyclopentyl]methanol
PubChem CID79655891
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name[1-(cyclopropylamino)-3-[1-methoxypropan-2-yl(methyl)amino]cyclopentyl]methanol
SMILESCOCC(C)N(C)C1CCC(CO)(NC2CC2)C1
InChIInChI=1S/C14H28N2O2/c1-11(9-18-3)16(2)13-6-7-14(8-13,10-17)15-12-4-5-12/h11-13,15,17H,4-10H2,1-3H3
InChIKeyUPNUHUOKWIHAAB-UHFFFAOYSA-N
XLogP0.99
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[3-[1-methoxypropan-2-yl(methyl)amino]-1-(propylamino)cyclopentyl]methanol
CID 79655810
methyl 1-(cyclopropylamino)-3-[1-methoxypropan-2-yl(methyl)amino]cyclopentane-1-carboxylate
CID 79655576
1-(cyclopropylamino)-3-[1-methoxypropan-2-yl(methyl)amino]cyclopentane-1-carbonitrile
CID 79639855
methyl 1-(cyclopropylamino)-3-[1-methoxypropan-2-yl(methyl)amino]cyclohexane-1-carboxylate
CID 79626176
[1-(cyclopropylamino)-3-(2-methylpropoxy)cyclopentyl]methanol
CID 79647999
[1-(cyclopropylamino)-3-methoxycyclopentyl]methanol
CID 79647805
[1-(methylamino)-3-[methyl(pentan-2-yl)amino]cyclopentyl]methanol
CID 79656781
[3-[cyclopentylmethyl(methyl)amino]-1-(cyclopropylamino)cyclopentyl]methanol
CID 79656502
[3-[butyl(ethyl)amino]-1-(cyclopropylamino)cyclopentyl]methanol
CID 79656594
[1-(methylamino)-3-[methyl(propan-2-yl)amino]cyclopentyl]methanol
CID 79656680
[1-(cyclopropylamino)-3-[methyl(2-methylpropyl)amino]cyclohexyl]methanol
CID 79634395
ethyl 1-amino-3-[1-methoxypropan-2-yl(methyl)amino]cyclopentane-1-carboxylate
CID 79655725

Frequently Asked Questions

What is the IUPAC name of [1-(cyclopropylamino)-3-[1-methoxypropan-2-yl(methyl)amino]cyclopentyl]methanol?
The IUPAC name of [1-(cyclopropylamino)-3-[1-methoxypropan-2-yl(methyl)amino]cyclopentyl]methanol (CID 79655891) is [1-(cyclopropylamino)-3-[1-methoxypropan-2-yl(methyl)amino]cyclopentyl]methanol.
What is the SMILES notation for [1-(cyclopropylamino)-3-[1-methoxypropan-2-yl(methyl)amino]cyclopentyl]methanol?
The canonical SMILES for [1-(cyclopropylamino)-3-[1-methoxypropan-2-yl(methyl)amino]cyclopentyl]methanol is COCC(C)N(C)C1CCC(CO)(NC2CC2)C1.
What is the InChIKey of [1-(cyclopropylamino)-3-[1-methoxypropan-2-yl(methyl)amino]cyclopentyl]methanol?
The InChIKey is UPNUHUOKWIHAAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-11(9-18-3)16(2)13-6-7-14(8-13,10-17)15-12-4-5-12/h11-13,15,17H,4-10H2,1-3H3.
What are the key properties of [1-(cyclopropylamino)-3-[1-methoxypropan-2-yl(methyl)amino]cyclopentyl]methanol?
[1-(cyclopropylamino)-3-[1-methoxypropan-2-yl(methyl)amino]cyclopentyl]methanol has a molecular weight of 256.39 g/mol, XLogP of 0.99, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(cyclopropylamino)-3-[1-methoxypropan-2-yl(methyl)amino]cyclopentyl]methanol is sourced from PubChem (CID 79655891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).