[1-amino-3-[2-methoxyethyl(propan-2-yl)amino]cyclopentyl]methanol

C12H26N2O2 — CID 82965328

IUPAC[1-amino-3-[2-methoxyethyl(propan-2-yl)amino]cyclopentyl]methanol
SMILESCOCCN(C(C)C)C1CCC(N)(CO)C1
InChIInChI=1S/C12H26N2O2/c1-10(2)14(6-7-16-3)11-4-5-12(13,8-11)9-15/h10-11,15H,4-9,13H2,1-3H3
InChIKeyFCKGLEQIAYVSBU-UHFFFAOYSA-N
MW230.35 g/mol
LogP0.59
Rot. Bonds6

About [1-amino-3-[2-methoxyethyl(propan-2-yl)amino]cyclopentyl]methanol

[1-amino-3-[2-methoxyethyl(propan-2-yl)amino]cyclopentyl]methanol (PubChem CID 82965328) has the molecular formula C12H26N2O2 and a molecular weight of 230.35 g/mol. Its IUPAC name is [1-amino-3-[2-methoxyethyl(propan-2-yl)amino]cyclopentyl]methanol.

Molecular Properties

Compound Name[1-amino-3-[2-methoxyethyl(propan-2-yl)amino]cyclopentyl]methanol
PubChem CID82965328
Molecular FormulaC12H26N2O2
Molecular Weight230.35 g/mol
Exact Mass230.20
IUPAC Name[1-amino-3-[2-methoxyethyl(propan-2-yl)amino]cyclopentyl]methanol
SMILESCOCCN(C(C)C)C1CCC(N)(CO)C1
InChIInChI=1S/C12H26N2O2/c1-10(2)14(6-7-16-3)11-4-5-12(13,8-11)9-15/h10-11,15H,4-9,13H2,1-3H3
InChIKeyFCKGLEQIAYVSBU-UHFFFAOYSA-N
XLogP0.59
TPSA58.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[1-amino-3-[propan-2-yl(propyl)amino]cyclopentyl]methanol
CID 79656528
[1-amino-3-[bis(2-methoxyethyl)amino]cyclopentyl]methanol
CID 79655898
[1-amino-3-(diethylamino)cyclopentyl]methanol
CID 79656193
[1-amino-3-(dibutylamino)cyclopentyl]methanol
CID 79656278
methyl 3-[2-methoxyethyl(propan-2-yl)amino]-1-(methylamino)cyclohexane-1-carboxylate
CID 82961022
[1-amino-3-[methyl(4-methylpentan-2-yl)amino]cyclopentyl]methanol
CID 79656226
[1-amino-3-[methyl(pentan-3-yl)amino]cyclopentyl]methanol
CID 79657029
[1-amino-3-[bis(2-methylpropyl)amino]cyclohexyl]methanol
CID 79640620
[1-amino-3-[ethyl(2-methylbutyl)amino]cyclopentyl]methanol
CID 79645998
[1-amino-3-[butan-2-yl(ethyl)amino]cyclohexyl]methanol
CID 79635540
[1-amino-3-[cyclopentyl(methyl)amino]cyclopentyl]methanol
CID 79656037
1-amino-3-[2-methoxyethyl(2-methylpropyl)amino]cyclohexane-1-carboxylic acid
CID 79641945

Frequently Asked Questions

What is the IUPAC name of [1-amino-3-[2-methoxyethyl(propan-2-yl)amino]cyclopentyl]methanol?
The IUPAC name of [1-amino-3-[2-methoxyethyl(propan-2-yl)amino]cyclopentyl]methanol (CID 82965328) is [1-amino-3-[2-methoxyethyl(propan-2-yl)amino]cyclopentyl]methanol.
What is the SMILES notation for [1-amino-3-[2-methoxyethyl(propan-2-yl)amino]cyclopentyl]methanol?
The canonical SMILES for [1-amino-3-[2-methoxyethyl(propan-2-yl)amino]cyclopentyl]methanol is COCCN(C(C)C)C1CCC(N)(CO)C1.
What is the InChIKey of [1-amino-3-[2-methoxyethyl(propan-2-yl)amino]cyclopentyl]methanol?
The InChIKey is FCKGLEQIAYVSBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2/c1-10(2)14(6-7-16-3)11-4-5-12(13,8-11)9-15/h10-11,15H,4-9,13H2,1-3H3.
What are the key properties of [1-amino-3-[2-methoxyethyl(propan-2-yl)amino]cyclopentyl]methanol?
[1-amino-3-[2-methoxyethyl(propan-2-yl)amino]cyclopentyl]methanol has a molecular weight of 230.35 g/mol, XLogP of 0.59, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-amino-3-[2-methoxyethyl(propan-2-yl)amino]cyclopentyl]methanol is sourced from PubChem (CID 82965328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).