2-methyl-1-(2-methylpropylamino)-3-quinolin-2-ylpropan-2-ol

C17H24N2O — CID 66037759

IUPAC2-methyl-1-(2-methylpropylamino)-3-quinolin-2-ylpropan-2-ol
SMILESCC(C)CNCC(C)(O)Cc1ccc2ccccc2n1
InChIInChI=1S/C17H24N2O/c1-13(2)11-18-12-17(3,20)10-15-9-8-14-6-4-5-7-16(14)19-15/h4-9,13,18,20H,10-12H2,1-3H3
InChIKeyAIKMYBOLUGMANL-UHFFFAOYSA-N
MW272.39 g/mol
LogP2.77
Rot. Bonds6

About 2-methyl-1-(2-methylpropylamino)-3-quinolin-2-ylpropan-2-ol

2-methyl-1-(2-methylpropylamino)-3-quinolin-2-ylpropan-2-ol (PubChem CID 66037759) has the molecular formula C17H24N2O and a molecular weight of 272.39 g/mol. Its IUPAC name is 2-methyl-1-(2-methylpropylamino)-3-quinolin-2-ylpropan-2-ol.

Molecular Properties

Compound Name2-methyl-1-(2-methylpropylamino)-3-quinolin-2-ylpropan-2-ol
PubChem CID66037759
Molecular FormulaC17H24N2O
Molecular Weight272.39 g/mol
Exact Mass272.19
IUPAC Name2-methyl-1-(2-methylpropylamino)-3-quinolin-2-ylpropan-2-ol
SMILESCC(C)CNCC(C)(O)Cc1ccc2ccccc2n1
InChIInChI=1S/C17H24N2O/c1-13(2)11-18-12-17(3,20)10-15-9-8-14-6-4-5-7-16(14)19-15/h4-9,13,18,20H,10-12H2,1-3H3
InChIKeyAIKMYBOLUGMANL-UHFFFAOYSA-N
XLogP2.77
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-(quinolin-2-ylmethyl)propan-1-amine
CID 28774774
2-methyl-1-(2-methylpropylamino)-3-(1-methyltriazol-4-yl)propan-2-ol
CID 107057685
CID 67646015
CID 67646015
2-methyl-1-(2-methylpropylamino)-4-phenylbutan-2-ol
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1-imidazo[2,1-b][1,3]thiazol-6-yl-2-methyl-3-(2-methylpropylamino)propan-2-ol
CID 113289464
2-methyl-2-(quinolin-2-ylmethyl)propanedinitrile
CID 134855925
1-(2-chloro-3-fluorophenyl)-2-methyl-3-(2-methylpropylamino)propan-2-ol
CID 112654826
4-methyl-N-(quinolin-2-ylmethyl)pentan-2-amine
CID 43372170
(2R)-2-(quinolin-2-ylmethylamino)propan-1-ol
CID 93083144
2-methyl-1-[methyl(quinolin-2-ylmethyl)amino]propan-2-ol
CID 78995605
2-methyl-N-(quinolin-2-ylmethyl)-2-thiophen-2-ylpropan-1-amine
CID 79032042
2-methyl-N-(2-quinolin-2-ylethyl)propan-2-amine
CID 62549000

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(2-methylpropylamino)-3-quinolin-2-ylpropan-2-ol?
The IUPAC name of 2-methyl-1-(2-methylpropylamino)-3-quinolin-2-ylpropan-2-ol (CID 66037759) is 2-methyl-1-(2-methylpropylamino)-3-quinolin-2-ylpropan-2-ol.
What is the SMILES notation for 2-methyl-1-(2-methylpropylamino)-3-quinolin-2-ylpropan-2-ol?
The canonical SMILES for 2-methyl-1-(2-methylpropylamino)-3-quinolin-2-ylpropan-2-ol is CC(C)CNCC(C)(O)Cc1ccc2ccccc2n1.
What is the InChIKey of 2-methyl-1-(2-methylpropylamino)-3-quinolin-2-ylpropan-2-ol?
The InChIKey is AIKMYBOLUGMANL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O/c1-13(2)11-18-12-17(3,20)10-15-9-8-14-6-4-5-7-16(14)19-15/h4-9,13,18,20H,10-12H2,1-3H3.
What are the key properties of 2-methyl-1-(2-methylpropylamino)-3-quinolin-2-ylpropan-2-ol?
2-methyl-1-(2-methylpropylamino)-3-quinolin-2-ylpropan-2-ol has a molecular weight of 272.39 g/mol, XLogP of 2.77, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(2-methylpropylamino)-3-quinolin-2-ylpropan-2-ol is sourced from PubChem (CID 66037759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).