2-methyl-1-(5,6,7,8-tetrahydroquinolin-8-ylamino)propan-2-ol

C13H20N2O — CID 79078513

IUPAC2-methyl-1-(5,6,7,8-tetrahydroquinolin-8-ylamino)propan-2-ol
SMILESCC(C)(O)CNC1CCCc2cccnc21
InChIInChI=1S/C13H20N2O/c1-13(2,16)9-15-11-7-3-5-10-6-4-8-14-12(10)11/h4,6,8,11,15-16H,3,5,7,9H2,1-2H3
InChIKeyWVFYKKBOCJQOBO-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.82
Rot. Bonds3

About 2-methyl-1-(5,6,7,8-tetrahydroquinolin-8-ylamino)propan-2-ol

2-methyl-1-(5,6,7,8-tetrahydroquinolin-8-ylamino)propan-2-ol (PubChem CID 79078513) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 2-methyl-1-(5,6,7,8-tetrahydroquinolin-8-ylamino)propan-2-ol.

Molecular Properties

Compound Name2-methyl-1-(5,6,7,8-tetrahydroquinolin-8-ylamino)propan-2-ol
PubChem CID79078513
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name2-methyl-1-(5,6,7,8-tetrahydroquinolin-8-ylamino)propan-2-ol
SMILESCC(C)(O)CNC1CCCc2cccnc21
InChIInChI=1S/C13H20N2O/c1-13(2,16)9-15-11-7-3-5-10-6-4-8-14-12(10)11/h4,6,8,11,15-16H,3,5,7,9H2,1-2H3
InChIKeyWVFYKKBOCJQOBO-UHFFFAOYSA-N
XLogP1.82
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-methyl-1-(5,6,7,8-tetrahydroquinolin-8-ylamino)propan-2-ol with MolForge

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Related Compounds

3,3-dimethyl-4-(5,6,7,8-tetrahydroquinolin-8-ylamino)butan-1-ol
CID 114149434
N-(2-methylprop-2-enyl)-5,6,7,8-tetrahydroquinolin-8-amine
CID 114615760
N-prop-2-ynyl-5,6,7,8-tetrahydroquinolin-8-amine
CID 79079711
N-[[4-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]phenyl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine
CID 71026047
(8S)-N-methyl-5,6,7,8-tetrahydroquinolin-8-amine
CID 58985331
N-(cyclopentylmethyl)-5,6,7,8-tetrahydroquinolin-8-amine
CID 79079348
tert-butyl N-[2-(5,6,7,8-tetrahydroquinolin-8-ylamino)ethyl]carbamate
CID 86621567
5-(5,6,7,8-tetrahydroquinolin-8-ylamino)pentan-1-ol
CID 107316747
3-methyl-4-(5,6,7,8-tetrahydroquinolin-8-ylamino)butan-1-ol
CID 79080089
1-(cyclopropylamino)-2-(5,6,7,8-tetrahydroquinolin-8-yl)propan-2-ol
CID 79738513
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)-4-methoxy-2-methylbutan-2-ol
CID 106249742
(8S)-N-benzyl-5,6,7,8-tetrahydroquinolin-8-amine
CID 11736560

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(5,6,7,8-tetrahydroquinolin-8-ylamino)propan-2-ol?
The IUPAC name of 2-methyl-1-(5,6,7,8-tetrahydroquinolin-8-ylamino)propan-2-ol (CID 79078513) is 2-methyl-1-(5,6,7,8-tetrahydroquinolin-8-ylamino)propan-2-ol.
What is the SMILES notation for 2-methyl-1-(5,6,7,8-tetrahydroquinolin-8-ylamino)propan-2-ol?
The canonical SMILES for 2-methyl-1-(5,6,7,8-tetrahydroquinolin-8-ylamino)propan-2-ol is CC(C)(O)CNC1CCCc2cccnc21.
What is the InChIKey of 2-methyl-1-(5,6,7,8-tetrahydroquinolin-8-ylamino)propan-2-ol?
The InChIKey is WVFYKKBOCJQOBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-13(2,16)9-15-11-7-3-5-10-6-4-8-14-12(10)11/h4,6,8,11,15-16H,3,5,7,9H2,1-2H3.
What are the key properties of 2-methyl-1-(5,6,7,8-tetrahydroquinolin-8-ylamino)propan-2-ol?
2-methyl-1-(5,6,7,8-tetrahydroquinolin-8-ylamino)propan-2-ol has a molecular weight of 220.32 g/mol, XLogP of 1.82, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(5,6,7,8-tetrahydroquinolin-8-ylamino)propan-2-ol is sourced from PubChem (CID 79078513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).