2-[[3-(dimethylamino)-2-hydroxypropyl]amino]cyclohexan-1-ol

C11H24N2O2 — CID 62358751

IUPAC2-[[3-(dimethylamino)-2-hydroxypropyl]amino]cyclohexan-1-ol
SMILESCN(C)CC(O)CNC1CCCCC1O
InChIInChI=1S/C11H24N2O2/c1-13(2)8-9(14)7-12-10-5-3-4-6-11(10)15/h9-12,14-15H,3-8H2,1-2H3
InChIKeyKDMLILUMZMQIHC-UHFFFAOYSA-N
MW216.32 g/mol
LogP-0.20
Rot. Bonds5

About 2-[[3-(dimethylamino)-2-hydroxypropyl]amino]cyclohexan-1-ol

2-[[3-(dimethylamino)-2-hydroxypropyl]amino]cyclohexan-1-ol (PubChem CID 62358751) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is 2-[[3-(dimethylamino)-2-hydroxypropyl]amino]cyclohexan-1-ol.

Molecular Properties

Compound Name2-[[3-(dimethylamino)-2-hydroxypropyl]amino]cyclohexan-1-ol
PubChem CID62358751
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC Name2-[[3-(dimethylamino)-2-hydroxypropyl]amino]cyclohexan-1-ol
SMILESCN(C)CC(O)CNC1CCCCC1O
InChIInChI=1S/C11H24N2O2/c1-13(2)8-9(14)7-12-10-5-3-4-6-11(10)15/h9-12,14-15H,3-8H2,1-2H3
InChIKeyKDMLILUMZMQIHC-UHFFFAOYSA-N
XLogP-0.20
TPSA55.73 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 5-0.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-1-[[(1R,2R)-2-benzylcyclopentyl]amino]-3-(dimethylamino)propan-2-ol
CID 99815208
trans-(1R,2R)-2-[(2-cyclopropyl-2-hydroxyethyl)amino]cyclohexan-1-ol
CID 102731241
2-[(2-cyclopropyl-2-hydroxyethyl)amino]cyclohexan-1-ol
CID 63298849
2-(2,2-dimethoxyethylamino)cyclohexan-1-ol
CID 63696910
trans-(1R,2R)-2-(2-cyclopropylpropylamino)cyclohexan-1-ol
CID 102731666
1-(dimethylamino)-3-[(3-methylcyclopentyl)amino]propan-2-ol
CID 115671208
2-[[2-hydroxy-3-(4-methylcyclohexyl)oxypropyl]amino]cyclohexan-1-ol
CID 62358746
trans-(1S,2S)-2-[(3-methyl-2-propan-2-ylbutyl)amino]cyclopentan-1-ol
CID 102905272
2-[(2-hydroxy-3-morpholin-4-ylpropyl)amino]cyclohexan-1-ol
CID 62360030
trans-(1S,2S)-2-[3-[methyl(propan-2-yl)amino]propylamino]cyclohexan-1-ol
CID 106045825
1-(dimethylamino)-3-[(3-methylcyclohexyl)amino]propan-2-ol
CID 60899512
1-(dimethylamino)-3-[(4-propylcyclohexyl)amino]propan-2-ol
CID 54962696

Frequently Asked Questions

What is the IUPAC name of 2-[[3-(dimethylamino)-2-hydroxypropyl]amino]cyclohexan-1-ol?
The IUPAC name of 2-[[3-(dimethylamino)-2-hydroxypropyl]amino]cyclohexan-1-ol (CID 62358751) is 2-[[3-(dimethylamino)-2-hydroxypropyl]amino]cyclohexan-1-ol.
What is the SMILES notation for 2-[[3-(dimethylamino)-2-hydroxypropyl]amino]cyclohexan-1-ol?
The canonical SMILES for 2-[[3-(dimethylamino)-2-hydroxypropyl]amino]cyclohexan-1-ol is CN(C)CC(O)CNC1CCCCC1O.
What is the InChIKey of 2-[[3-(dimethylamino)-2-hydroxypropyl]amino]cyclohexan-1-ol?
The InChIKey is KDMLILUMZMQIHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-13(2)8-9(14)7-12-10-5-3-4-6-11(10)15/h9-12,14-15H,3-8H2,1-2H3.
What are the key properties of 2-[[3-(dimethylamino)-2-hydroxypropyl]amino]cyclohexan-1-ol?
2-[[3-(dimethylamino)-2-hydroxypropyl]amino]cyclohexan-1-ol has a molecular weight of 216.32 g/mol, XLogP of -0.20, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[3-(dimethylamino)-2-hydroxypropyl]amino]cyclohexan-1-ol is sourced from PubChem (CID 62358751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).