1-(cyclopropylamino)-3-(3,5-dimethylcyclohexyl)oxy-2-methylpropan-2-ol

C15H29NO2 — CID 66335664

IUPAC1-(cyclopropylamino)-3-(3,5-dimethylcyclohexyl)oxy-2-methylpropan-2-ol
SMILESCC1CC(C)CC(OCC(C)(O)CNC2CC2)C1
InChIInChI=1S/C15H29NO2/c1-11-6-12(2)8-14(7-11)18-10-15(3,17)9-16-13-4-5-13/h11-14,16-17H,4-10H2,1-3H3
InChIKeyMOLZJJLCWZNQNL-UHFFFAOYSA-N
MW255.40 g/mol
LogP2.33
Rot. Bonds6

About 1-(cyclopropylamino)-3-(3,5-dimethylcyclohexyl)oxy-2-methylpropan-2-ol

1-(cyclopropylamino)-3-(3,5-dimethylcyclohexyl)oxy-2-methylpropan-2-ol (PubChem CID 66335664) has the molecular formula C15H29NO2 and a molecular weight of 255.40 g/mol. Its IUPAC name is 1-(cyclopropylamino)-3-(3,5-dimethylcyclohexyl)oxy-2-methylpropan-2-ol.

Molecular Properties

Compound Name1-(cyclopropylamino)-3-(3,5-dimethylcyclohexyl)oxy-2-methylpropan-2-ol
PubChem CID66335664
Molecular FormulaC15H29NO2
Molecular Weight255.40 g/mol
Exact Mass255.22
IUPAC Name1-(cyclopropylamino)-3-(3,5-dimethylcyclohexyl)oxy-2-methylpropan-2-ol
SMILESCC1CC(C)CC(OCC(C)(O)CNC2CC2)C1
InChIInChI=1S/C15H29NO2/c1-11-6-12(2)8-14(7-11)18-10-15(3,17)9-16-13-4-5-13/h11-14,16-17H,4-10H2,1-3H3
InChIKeyMOLZJJLCWZNQNL-UHFFFAOYSA-N
XLogP2.33
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.40
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(cyclopropylamino)-3-(3-ethylcyclohexyl)oxy-2-methylpropan-2-ol
CID 66335215
3-(cyclopropylamino)-2-methylpropane-1,2-diol
CID 66335197
1-(cyclopropylamino)-3-(3,3-dimethylbutoxy)-2-methylpropan-2-ol
CID 66334601
1-butoxy-3-(cyclopropylamino)-2-methylpropan-2-ol
CID 66334437
1-(cyclopropylamino)-3-[2-(2-methoxyethoxy)ethoxy]-2-methylpropan-2-ol
CID 104561121
4-methoxy-2-methyl-1-[(3-methylcyclopentyl)amino]butan-2-ol
CID 103699568
1-cycloheptyloxy-3-(ethylamino)-2-methylpropan-2-ol
CID 66335655
1-(cyclopropylamino)-2-methyl-3-octan-2-yloxypropan-2-ol
CID 66334578
1-(cyclopropylamino)-2-methyloctan-2-ol
CID 62774325
2-(cyclopropylamino)-5-(3,5-dimethylcyclohexyl)oxy-2-methylpentan-1-ol
CID 64808158
1-(cyclopropylamino)-2-methyl-3-(2-methylpentoxy)propan-2-ol
CID 103283560
4-methoxy-2-methyl-1-[(4-methylcycloheptyl)amino]butan-2-ol
CID 106249580

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylamino)-3-(3,5-dimethylcyclohexyl)oxy-2-methylpropan-2-ol?
The IUPAC name of 1-(cyclopropylamino)-3-(3,5-dimethylcyclohexyl)oxy-2-methylpropan-2-ol (CID 66335664) is 1-(cyclopropylamino)-3-(3,5-dimethylcyclohexyl)oxy-2-methylpropan-2-ol.
What is the SMILES notation for 1-(cyclopropylamino)-3-(3,5-dimethylcyclohexyl)oxy-2-methylpropan-2-ol?
The canonical SMILES for 1-(cyclopropylamino)-3-(3,5-dimethylcyclohexyl)oxy-2-methylpropan-2-ol is CC1CC(C)CC(OCC(C)(O)CNC2CC2)C1.
What is the InChIKey of 1-(cyclopropylamino)-3-(3,5-dimethylcyclohexyl)oxy-2-methylpropan-2-ol?
The InChIKey is MOLZJJLCWZNQNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO2/c1-11-6-12(2)8-14(7-11)18-10-15(3,17)9-16-13-4-5-13/h11-14,16-17H,4-10H2,1-3H3.
What are the key properties of 1-(cyclopropylamino)-3-(3,5-dimethylcyclohexyl)oxy-2-methylpropan-2-ol?
1-(cyclopropylamino)-3-(3,5-dimethylcyclohexyl)oxy-2-methylpropan-2-ol has a molecular weight of 255.40 g/mol, XLogP of 2.33, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylamino)-3-(3,5-dimethylcyclohexyl)oxy-2-methylpropan-2-ol is sourced from PubChem (CID 66335664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).