1-(dimethylamino)-3-pyridin-3-ylpropan-2-ol

C10H16N2O — CID 104736153

IUPAC1-(dimethylamino)-3-pyridin-3-ylpropan-2-ol
SMILESCN(C)CC(O)Cc1cccnc1
InChIInChI=1S/C10H16N2O/c1-12(2)8-10(13)6-9-4-3-5-11-7-9/h3-5,7,10,13H,6,8H2,1-2H3
InChIKeyUJEBNITVYQFRAS-UHFFFAOYSA-N
MW180.25 g/mol
LogP0.55
Rot. Bonds4

About 1-(dimethylamino)-3-pyridin-3-ylpropan-2-ol

1-(dimethylamino)-3-pyridin-3-ylpropan-2-ol (PubChem CID 104736153) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is 1-(dimethylamino)-3-pyridin-3-ylpropan-2-ol.

Molecular Properties

Compound Name1-(dimethylamino)-3-pyridin-3-ylpropan-2-ol
PubChem CID104736153
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Name1-(dimethylamino)-3-pyridin-3-ylpropan-2-ol
SMILESCN(C)CC(O)Cc1cccnc1
InChIInChI=1S/C10H16N2O/c1-12(2)8-10(13)6-9-4-3-5-11-7-9/h3-5,7,10,13H,6,8H2,1-2H3
InChIKeyUJEBNITVYQFRAS-UHFFFAOYSA-N
XLogP0.55
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-pyridin-3-ylpentan-2-ol
CID 62553061
1-amino-3-pyridin-3-ylpropan-2-ol
CID 56924494
1-methylsulfonyl-3-pyridin-3-ylpropan-2-ol
CID 115832186
4-propan-2-yloxy-1-pyridin-3-ylbutan-2-ol
CID 114998518
1-(1-methylpyrazol-3-yl)-3-pyridin-3-ylpropan-2-ol
CID 82869029
5-methylsulfanyl-1-pyridin-3-ylpentan-2-ol
CID 103089755
1-N,1-N-dimethyl-4-pyridin-3-ylbutane-1,3-diamine
CID 104736690
4-propoxy-1-pyridin-3-ylbutan-2-ol
CID 105125026
1-(2-methylpropylamino)-3-[methyl(pyridin-3-ylmethyl)amino]propan-2-ol
CID 115474925
1-(2,5-dimethylphenyl)-3-pyridin-3-ylpropan-2-ol
CID 62552066
1-cyclohexyl-3-pyridin-3-ylpropan-2-ol
CID 62605827
1-(2-bromophenyl)-3-pyridin-3-ylpropan-2-ol
CID 62553405

Frequently Asked Questions

What is the IUPAC name of 1-(dimethylamino)-3-pyridin-3-ylpropan-2-ol?
The IUPAC name of 1-(dimethylamino)-3-pyridin-3-ylpropan-2-ol (CID 104736153) is 1-(dimethylamino)-3-pyridin-3-ylpropan-2-ol.
What is the SMILES notation for 1-(dimethylamino)-3-pyridin-3-ylpropan-2-ol?
The canonical SMILES for 1-(dimethylamino)-3-pyridin-3-ylpropan-2-ol is CN(C)CC(O)Cc1cccnc1.
What is the InChIKey of 1-(dimethylamino)-3-pyridin-3-ylpropan-2-ol?
The InChIKey is UJEBNITVYQFRAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-12(2)8-10(13)6-9-4-3-5-11-7-9/h3-5,7,10,13H,6,8H2,1-2H3.
What are the key properties of 1-(dimethylamino)-3-pyridin-3-ylpropan-2-ol?
1-(dimethylamino)-3-pyridin-3-ylpropan-2-ol has a molecular weight of 180.25 g/mol, XLogP of 0.55, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(dimethylamino)-3-pyridin-3-ylpropan-2-ol is sourced from PubChem (CID 104736153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).