O-[2-(1-methyl-3,4-dihydro-2H-quinolin-7-yl)ethyl]hydroxylamine

C12H18N2O — CID 117295178

IUPACO-[2-(1-methyl-3,4-dihydro-2H-quinolin-7-yl)ethyl]hydroxylamine
SMILESCN1CCCc2ccc(CCON)cc21
InChIInChI=1S/C12H18N2O/c1-14-7-2-3-11-5-4-10(6-8-15-13)9-12(11)14/h4-5,9H,2-3,6-8,13H2,1H3
InChIKeyGBZSAGJRZFNWQJ-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.50
Rot. Bonds3

About O-[2-(1-methyl-3,4-dihydro-2H-quinolin-7-yl)ethyl]hydroxylamine

O-[2-(1-methyl-3,4-dihydro-2H-quinolin-7-yl)ethyl]hydroxylamine (PubChem CID 117295178) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is O-[2-(1-methyl-3,4-dihydro-2H-quinolin-7-yl)ethyl]hydroxylamine.

Molecular Properties

Compound NameO-[2-(1-methyl-3,4-dihydro-2H-quinolin-7-yl)ethyl]hydroxylamine
PubChem CID117295178
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC NameO-[2-(1-methyl-3,4-dihydro-2H-quinolin-7-yl)ethyl]hydroxylamine
SMILESCN1CCCc2ccc(CCON)cc21
InChIInChI=1S/C12H18N2O/c1-14-7-2-3-11-5-4-10(6-8-15-13)9-12(11)14/h4-5,9H,2-3,6-8,13H2,1H3
InChIKeyGBZSAGJRZFNWQJ-UHFFFAOYSA-N
XLogP1.50
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

O-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]hydroxylamine
CID 83482053
2-[(1-methyl-3,4-dihydro-2H-quinolin-7-yl)oxy]ethanamine
CID 84674571
7-fluoro-1-methyl-3,4-dihydro-2H-quinoline
CID 129259469
7-bromo-1-methyl-3,4-dihydro-2H-quinoline
CID 82618152
ethane;7-fluoro-1-methyl-3,4-dihydro-2H-quinoline
CID 145098323
1-methyl-7-(piperidin-3-ylmethyl)-3,4-dihydro-2H-quinoline
CID 117363448
1-methyl-3,4-dihydro-2H-quinoline-7-carbaldehyde
CID 82411141
2-(1-propan-2-yl-3,4-dihydro-2H-quinolin-7-yl)ethanamine
CID 82263620
methane;1-methyl-3,4-dihydro-2H-quinoline
CID 158932753
2-methyl-N-[2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)ethyl]propanamide
CID 16837096
2-methyl-2-(1-methyl-3,4-dihydro-2H-quinolin-7-yl)propan-1-ol
CID 117313410
methane;1-methyl-2,3,4,5-tetrahydro-1-benzazepine
CID 161272103

Frequently Asked Questions

What is the IUPAC name of O-[2-(1-methyl-3,4-dihydro-2H-quinolin-7-yl)ethyl]hydroxylamine?
The IUPAC name of O-[2-(1-methyl-3,4-dihydro-2H-quinolin-7-yl)ethyl]hydroxylamine (CID 117295178) is O-[2-(1-methyl-3,4-dihydro-2H-quinolin-7-yl)ethyl]hydroxylamine.
What is the SMILES notation for O-[2-(1-methyl-3,4-dihydro-2H-quinolin-7-yl)ethyl]hydroxylamine?
The canonical SMILES for O-[2-(1-methyl-3,4-dihydro-2H-quinolin-7-yl)ethyl]hydroxylamine is CN1CCCc2ccc(CCON)cc21.
What is the InChIKey of O-[2-(1-methyl-3,4-dihydro-2H-quinolin-7-yl)ethyl]hydroxylamine?
The InChIKey is GBZSAGJRZFNWQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-14-7-2-3-11-5-4-10(6-8-15-13)9-12(11)14/h4-5,9H,2-3,6-8,13H2,1H3.
What are the key properties of O-[2-(1-methyl-3,4-dihydro-2H-quinolin-7-yl)ethyl]hydroxylamine?
O-[2-(1-methyl-3,4-dihydro-2H-quinolin-7-yl)ethyl]hydroxylamine has a molecular weight of 206.29 g/mol, XLogP of 1.50, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for O-[2-(1-methyl-3,4-dihydro-2H-quinolin-7-yl)ethyl]hydroxylamine is sourced from PubChem (CID 117295178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).