[1-(ethylamino)-3-[methyl-(1-methylpiperidin-4-yl)amino]cyclopentyl]methanol

C15H31N3O — CID 79656682

IUPAC[1-(ethylamino)-3-[methyl-(1-methylpiperidin-4-yl)amino]cyclopentyl]methanol
SMILESCCNC1(CO)CCC(N(C)C2CCN(C)CC2)C1
InChIInChI=1S/C15H31N3O/c1-4-16-15(12-19)8-5-14(11-15)18(3)13-6-9-17(2)10-7-13/h13-14,16,19H,4-12H2,1-3H3
InChIKeyPUCJMEJMBYKQTK-UHFFFAOYSA-N
MW269.43 g/mol
LogP0.91
Rot. Bonds5

About [1-(ethylamino)-3-[methyl-(1-methylpiperidin-4-yl)amino]cyclopentyl]methanol

[1-(ethylamino)-3-[methyl-(1-methylpiperidin-4-yl)amino]cyclopentyl]methanol (PubChem CID 79656682) has the molecular formula C15H31N3O and a molecular weight of 269.43 g/mol. Its IUPAC name is [1-(ethylamino)-3-[methyl-(1-methylpiperidin-4-yl)amino]cyclopentyl]methanol.

Molecular Properties

Compound Name[1-(ethylamino)-3-[methyl-(1-methylpiperidin-4-yl)amino]cyclopentyl]methanol
PubChem CID79656682
Molecular FormulaC15H31N3O
Molecular Weight269.43 g/mol
Exact Mass269.25
IUPAC Name[1-(ethylamino)-3-[methyl-(1-methylpiperidin-4-yl)amino]cyclopentyl]methanol
SMILESCCNC1(CO)CCC(N(C)C2CCN(C)CC2)C1
InChIInChI=1S/C15H31N3O/c1-4-16-15(12-19)8-5-14(11-15)18(3)13-6-9-17(2)10-7-13/h13-14,16,19H,4-12H2,1-3H3
InChIKeyPUCJMEJMBYKQTK-UHFFFAOYSA-N
XLogP0.91
TPSA38.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[3-[cycloheptyl(methyl)amino]-1-(ethylamino)cyclopentyl]methanol
CID 79655884
[1-(ethylamino)-3-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]cyclopentyl]methanol
CID 79656509
[1-(ethylamino)-3-[(1-ethylpiperidin-4-yl)-methylamino]cyclohexyl]methanol
CID 79635686
[1-(ethylamino)-3-[methyl(2-pyrrolidin-1-ylethyl)amino]cyclopentyl]methanol
CID 79656265
[1-(ethylamino)-3-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]cyclopentyl]methanol
CID 79644725
[1-(ethylamino)-3-[methyl(oxan-4-yl)amino]cyclohexyl]methanol
CID 79641104
[3-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]-1-(propylamino)cyclopentyl]methanol
CID 79647008
[1-(ethylamino)-3-[methyl-(2-methyloxolan-3-yl)amino]cyclopentyl]methanol
CID 82744783
[1-(ethylamino)-3-[methyl(2-methylpropyl)amino]cyclopentyl]methanol
CID 79656684
[3-[methyl(oxan-4-yl)amino]-1-(propylamino)cyclopentyl]methanol
CID 79655803
[1-(ethylamino)-3-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]cyclohexyl]methanol
CID 79640639
[3-[cyclohexyl(methyl)amino]-1-(propylamino)cyclohexyl]methanol
CID 79635204

Frequently Asked Questions

What is the IUPAC name of [1-(ethylamino)-3-[methyl-(1-methylpiperidin-4-yl)amino]cyclopentyl]methanol?
The IUPAC name of [1-(ethylamino)-3-[methyl-(1-methylpiperidin-4-yl)amino]cyclopentyl]methanol (CID 79656682) is [1-(ethylamino)-3-[methyl-(1-methylpiperidin-4-yl)amino]cyclopentyl]methanol.
What is the SMILES notation for [1-(ethylamino)-3-[methyl-(1-methylpiperidin-4-yl)amino]cyclopentyl]methanol?
The canonical SMILES for [1-(ethylamino)-3-[methyl-(1-methylpiperidin-4-yl)amino]cyclopentyl]methanol is CCNC1(CO)CCC(N(C)C2CCN(C)CC2)C1.
What is the InChIKey of [1-(ethylamino)-3-[methyl-(1-methylpiperidin-4-yl)amino]cyclopentyl]methanol?
The InChIKey is PUCJMEJMBYKQTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O/c1-4-16-15(12-19)8-5-14(11-15)18(3)13-6-9-17(2)10-7-13/h13-14,16,19H,4-12H2,1-3H3.
What are the key properties of [1-(ethylamino)-3-[methyl-(1-methylpiperidin-4-yl)amino]cyclopentyl]methanol?
[1-(ethylamino)-3-[methyl-(1-methylpiperidin-4-yl)amino]cyclopentyl]methanol has a molecular weight of 269.43 g/mol, XLogP of 0.91, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(ethylamino)-3-[methyl-(1-methylpiperidin-4-yl)amino]cyclopentyl]methanol is sourced from PubChem (CID 79656682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).