1-amino-4-(3,4-dihydro-2H-quinolin-1-yl)butan-2-ol

C13H20N2O — CID 64820971

IUPAC1-amino-4-(3,4-dihydro-2H-quinolin-1-yl)butan-2-ol
SMILESNCC(O)CCN1CCCc2ccccc21
InChIInChI=1S/C13H20N2O/c14-10-12(16)7-9-15-8-3-5-11-4-1-2-6-13(11)15/h1-2,4,6,12,16H,3,5,7-10,14H2
InChIKeyRPDYEGKHDSXRSV-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.15
Rot. Bonds4

About 1-amino-4-(3,4-dihydro-2H-quinolin-1-yl)butan-2-ol

1-amino-4-(3,4-dihydro-2H-quinolin-1-yl)butan-2-ol (PubChem CID 64820971) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 1-amino-4-(3,4-dihydro-2H-quinolin-1-yl)butan-2-ol.

Molecular Properties

Compound Name1-amino-4-(3,4-dihydro-2H-quinolin-1-yl)butan-2-ol
PubChem CID64820971
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name1-amino-4-(3,4-dihydro-2H-quinolin-1-yl)butan-2-ol
SMILESNCC(O)CCN1CCCc2ccccc21
InChIInChI=1S/C13H20N2O/c14-10-12(16)7-9-15-8-3-5-11-4-1-2-6-13(11)15/h1-2,4,6,12,16H,3,5,7-10,14H2
InChIKeyRPDYEGKHDSXRSV-UHFFFAOYSA-N
XLogP1.15
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-4-(3,4-dihydro-2H-quinolin-1-yl)butanenitrile
CID 63028093
1-amino-4-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)butan-2-ol
CID 64818927
3-(3,4-dihydro-2H-quinolin-1-yl)-1-(4-methylphenyl)propan-1-ol
CID 62618632
3-(3,4-dihydro-2H-quinolin-1-yl)-1-(4-fluorophenyl)propan-1-ol
CID 62643201
(2S,11R)-1,12-bis(3,4-dihydro-2H-quinolin-1-yl)dodecane-2,11-diol
CID 92532372
8-(3,4-dihydro-2H-quinolin-1-yl)octan-1-amine
CID 13472131
6-(3,4-dihydro-2H-quinolin-1-yl)hexan-1-amine
CID 13472128
3-(3,4-dihydro-2H-quinolin-1-yl)-1-(2-methylphenyl)propan-1-amine
CID 62629564
2-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]guanidine
CID 82285615
2-[3-(3,4-dihydro-2H-quinolin-1-yl)-2-hydroxypropyl]guanidine
CID 3095129
2-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)ethanol
CID 15488047
1-(2-pyrrolidin-1-ylethyl)-3,4-dihydro-2H-quinoline
CID 59807075

Frequently Asked Questions

What is the IUPAC name of 1-amino-4-(3,4-dihydro-2H-quinolin-1-yl)butan-2-ol?
The IUPAC name of 1-amino-4-(3,4-dihydro-2H-quinolin-1-yl)butan-2-ol (CID 64820971) is 1-amino-4-(3,4-dihydro-2H-quinolin-1-yl)butan-2-ol.
What is the SMILES notation for 1-amino-4-(3,4-dihydro-2H-quinolin-1-yl)butan-2-ol?
The canonical SMILES for 1-amino-4-(3,4-dihydro-2H-quinolin-1-yl)butan-2-ol is NCC(O)CCN1CCCc2ccccc21.
What is the InChIKey of 1-amino-4-(3,4-dihydro-2H-quinolin-1-yl)butan-2-ol?
The InChIKey is RPDYEGKHDSXRSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c14-10-12(16)7-9-15-8-3-5-11-4-1-2-6-13(11)15/h1-2,4,6,12,16H,3,5,7-10,14H2.
What are the key properties of 1-amino-4-(3,4-dihydro-2H-quinolin-1-yl)butan-2-ol?
1-amino-4-(3,4-dihydro-2H-quinolin-1-yl)butan-2-ol has a molecular weight of 220.32 g/mol, XLogP of 1.15, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-4-(3,4-dihydro-2H-quinolin-1-yl)butan-2-ol is sourced from PubChem (CID 64820971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).