2-(propan-2-ylamino)-2-quinolin-8-ylethanol

C14H18N2O — CID 63968321

IUPAC2-(propan-2-ylamino)-2-quinolin-8-ylethanol
SMILESCC(C)NC(CO)c1cccc2cccnc12
InChIInChI=1S/C14H18N2O/c1-10(2)16-13(9-17)12-7-3-5-11-6-4-8-15-14(11)12/h3-8,10,13,16-17H,9H2,1-2H3
InChIKeyDSWAZCKCFWTULH-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.27
Rot. Bonds4

About 2-(propan-2-ylamino)-2-quinolin-8-ylethanol

2-(propan-2-ylamino)-2-quinolin-8-ylethanol (PubChem CID 63968321) has the molecular formula C14H18N2O and a molecular weight of 230.31 g/mol. Its IUPAC name is 2-(propan-2-ylamino)-2-quinolin-8-ylethanol.

Molecular Properties

Compound Name2-(propan-2-ylamino)-2-quinolin-8-ylethanol
PubChem CID63968321
Molecular FormulaC14H18N2O
Molecular Weight230.31 g/mol
Exact Mass230.14
IUPAC Name2-(propan-2-ylamino)-2-quinolin-8-ylethanol
SMILESCC(C)NC(CO)c1cccc2cccnc12
InChIInChI=1S/C14H18N2O/c1-10(2)16-13(9-17)12-7-3-5-11-6-4-8-15-14(11)12/h3-8,10,13,16-17H,9H2,1-2H3
InChIKeyDSWAZCKCFWTULH-UHFFFAOYSA-N
XLogP2.27
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cycloheptylamino)-2-quinolin-8-ylethanol
CID 63970830
2-(cyclopropylamino)-2-quinolin-8-ylethanol
CID 63970835
N-propan-2-yl-3-quinolin-8-ylbutan-2-amine
CID 81224234
N-methyl-1-quinolin-8-ylbut-3-yn-1-amine
CID 105077186
3,3,3-trifluoro-N-methyl-1-quinolin-8-ylpropan-1-amine
CID 81231735
N-methyl-1-quinolin-8-ylpent-4-yn-1-amine
CID 105148985
5-methyl-1-quinolin-8-ylhexan-1-ol
CID 83158737
ethyl 3-(methylamino)-3-quinolin-8-ylpropanoate
CID 65236794
(3R)-3-acetamido-3-quinolin-8-ylpropanoic acid
CID 63968660
N-ethyl-3-methyl-1-quinolin-8-ylbut-3-en-1-amine
CID 105163061
[2-(2-methylpropylsulfanyl)-1-quinolin-8-ylethyl]hydrazine
CID 105226697
2-amino-1-quinolin-8-ylpropan-1-ol
CID 63969290

Frequently Asked Questions

What is the IUPAC name of 2-(propan-2-ylamino)-2-quinolin-8-ylethanol?
The IUPAC name of 2-(propan-2-ylamino)-2-quinolin-8-ylethanol (CID 63968321) is 2-(propan-2-ylamino)-2-quinolin-8-ylethanol.
What is the SMILES notation for 2-(propan-2-ylamino)-2-quinolin-8-ylethanol?
The canonical SMILES for 2-(propan-2-ylamino)-2-quinolin-8-ylethanol is CC(C)NC(CO)c1cccc2cccnc12.
What is the InChIKey of 2-(propan-2-ylamino)-2-quinolin-8-ylethanol?
The InChIKey is DSWAZCKCFWTULH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O/c1-10(2)16-13(9-17)12-7-3-5-11-6-4-8-15-14(11)12/h3-8,10,13,16-17H,9H2,1-2H3.
What are the key properties of 2-(propan-2-ylamino)-2-quinolin-8-ylethanol?
2-(propan-2-ylamino)-2-quinolin-8-ylethanol has a molecular weight of 230.31 g/mol, XLogP of 2.27, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(propan-2-ylamino)-2-quinolin-8-ylethanol is sourced from PubChem (CID 63968321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).