1-(diethylamino)-3-[(3,4-dimethylcyclohexyl)amino]propan-2-ol

C15H32N2O — CID 64743461

IUPAC1-(diethylamino)-3-[(3,4-dimethylcyclohexyl)amino]propan-2-ol
SMILESCCN(CC)CC(O)CNC1CCC(C)C(C)C1
InChIInChI=1S/C15H32N2O/c1-5-17(6-2)11-15(18)10-16-14-8-7-12(3)13(4)9-14/h12-16,18H,5-11H2,1-4H3
InChIKeyLXLZGGGUIVEDGB-UHFFFAOYSA-N
MW256.43 g/mol
LogP2.10
Rot. Bonds7

About 1-(diethylamino)-3-[(3,4-dimethylcyclohexyl)amino]propan-2-ol

1-(diethylamino)-3-[(3,4-dimethylcyclohexyl)amino]propan-2-ol (PubChem CID 64743461) has the molecular formula C15H32N2O and a molecular weight of 256.43 g/mol. Its IUPAC name is 1-(diethylamino)-3-[(3,4-dimethylcyclohexyl)amino]propan-2-ol.

Molecular Properties

Compound Name1-(diethylamino)-3-[(3,4-dimethylcyclohexyl)amino]propan-2-ol
PubChem CID64743461
Molecular FormulaC15H32N2O
Molecular Weight256.43 g/mol
Exact Mass256.25
IUPAC Name1-(diethylamino)-3-[(3,4-dimethylcyclohexyl)amino]propan-2-ol
SMILESCCN(CC)CC(O)CNC1CCC(C)C(C)C1
InChIInChI=1S/C15H32N2O/c1-5-17(6-2)11-15(18)10-16-14-8-7-12(3)13(4)9-14/h12-16,18H,5-11H2,1-4H3
InChIKeyLXLZGGGUIVEDGB-UHFFFAOYSA-N
XLogP2.10
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.43
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-1-[[(1S,3S,4R)-3,4-dimethylcyclohexyl]amino]propan-2-ol
CID 96732492
1-(diethylamino)-3-[(3-methylsulfanylcyclohexyl)amino]propan-2-ol
CID 114123069
1-(cyclopropylmethoxy)-3-[(3,4-dimethylcyclohexyl)amino]propan-2-ol
CID 64742863
1-(dimethylamino)-3-[(3-methylcyclopentyl)amino]propan-2-ol
CID 115671208
1-[(3,4-dimethylcyclohexyl)amino]-3-phenylmethoxypropan-2-ol
CID 64742870
1-(diethylamino)-3-[(2-methoxycyclopentyl)amino]propan-2-ol
CID 55033366
1-(dimethylamino)-3-[(3-methylcyclohexyl)amino]propan-2-ol
CID 60899512
2-[(3,4-dimethylcyclohexyl)amino]-N-ethyl-N-methylacetamide
CID 64743255
1-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-3-(diethylamino)propan-2-ol
CID 60710698
1-[(3,4-dimethylcyclohexyl)amino]-3-(3-methylphenoxy)propan-2-ol
CID 64741127
N-(3,4-dimethylcyclohexyl)-N'-methyl-N'-propan-2-ylethane-1,2-diamine
CID 64746812
1-(cyclopropylamino)-3-[methyl-(3-methylcyclohexyl)amino]propan-2-ol
CID 61447892

Frequently Asked Questions

What is the IUPAC name of 1-(diethylamino)-3-[(3,4-dimethylcyclohexyl)amino]propan-2-ol?
The IUPAC name of 1-(diethylamino)-3-[(3,4-dimethylcyclohexyl)amino]propan-2-ol (CID 64743461) is 1-(diethylamino)-3-[(3,4-dimethylcyclohexyl)amino]propan-2-ol.
What is the SMILES notation for 1-(diethylamino)-3-[(3,4-dimethylcyclohexyl)amino]propan-2-ol?
The canonical SMILES for 1-(diethylamino)-3-[(3,4-dimethylcyclohexyl)amino]propan-2-ol is CCN(CC)CC(O)CNC1CCC(C)C(C)C1.
What is the InChIKey of 1-(diethylamino)-3-[(3,4-dimethylcyclohexyl)amino]propan-2-ol?
The InChIKey is LXLZGGGUIVEDGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O/c1-5-17(6-2)11-15(18)10-16-14-8-7-12(3)13(4)9-14/h12-16,18H,5-11H2,1-4H3.
What are the key properties of 1-(diethylamino)-3-[(3,4-dimethylcyclohexyl)amino]propan-2-ol?
1-(diethylamino)-3-[(3,4-dimethylcyclohexyl)amino]propan-2-ol has a molecular weight of 256.43 g/mol, XLogP of 2.10, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(diethylamino)-3-[(3,4-dimethylcyclohexyl)amino]propan-2-ol is sourced from PubChem (CID 64743461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).