N-ethyl-2,2-dimethoxy-1-quinolin-6-ylethanamine

C15H20N2O2 — CID 81232075

IUPACN-ethyl-2,2-dimethoxy-1-quinolin-6-ylethanamine
SMILESCCNC(c1ccc2ncccc2c1)C(OC)OC
InChIInChI=1S/C15H20N2O2/c1-4-16-14(15(18-2)19-3)12-7-8-13-11(10-12)6-5-9-17-13/h5-10,14-16H,4H2,1-3H3
InChIKeyMWDXXPDPIBAFAP-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.50
Rot. Bonds6

About N-ethyl-2,2-dimethoxy-1-quinolin-6-ylethanamine

N-ethyl-2,2-dimethoxy-1-quinolin-6-ylethanamine (PubChem CID 81232075) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is N-ethyl-2,2-dimethoxy-1-quinolin-6-ylethanamine.

Molecular Properties

Compound NameN-ethyl-2,2-dimethoxy-1-quinolin-6-ylethanamine
PubChem CID81232075
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC NameN-ethyl-2,2-dimethoxy-1-quinolin-6-ylethanamine
SMILESCCNC(c1ccc2ncccc2c1)C(OC)OC
InChIInChI=1S/C15H20N2O2/c1-4-16-14(15(18-2)19-3)12-7-8-13-11(10-12)6-5-9-17-13/h5-10,14-16H,4H2,1-3H3
InChIKeyMWDXXPDPIBAFAP-UHFFFAOYSA-N
XLogP2.50
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

2-ethoxy-N-ethyl-2-methyl-1-quinolin-6-ylpropan-1-amine
CID 116726919
2-methoxy-N,3-dimethyl-1-quinolin-6-ylbutan-1-amine
CID 116720092
(2-ethyl-1-quinolin-6-ylbutyl)hydrazine
CID 105218482
N-[(3-methylphenyl)-quinolin-6-ylmethyl]ethanamine
CID 63095453
N-ethyl-1-quinolin-6-ylbut-3-en-1-amine
CID 55181079
N-ethyl-2,2-dimethoxy-1-quinolin-5-ylethanamine
CID 81231933
N-[(1-methylcyclopentyl)-quinolin-6-ylmethyl]ethanamine
CID 105021107
N-ethyl-2-methylsulfonyl-1-quinolin-6-ylethanamine
CID 105021031
2-ethoxy-N-ethyl-1-quinolin-7-ylpropan-1-amine
CID 81231185
N-[2,3-dihydrofuran-5-yl(quinolin-6-yl)methyl]ethanamine
CID 102651527
2-ethoxy-N,3-dimethyl-1-quinolin-6-ylbutan-1-amine
CID 116721238
N-[(2-bromofuran-3-yl)-quinolin-6-ylmethyl]ethanamine
CID 106858324

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,2-dimethoxy-1-quinolin-6-ylethanamine?
The IUPAC name of N-ethyl-2,2-dimethoxy-1-quinolin-6-ylethanamine (CID 81232075) is N-ethyl-2,2-dimethoxy-1-quinolin-6-ylethanamine.
What is the SMILES notation for N-ethyl-2,2-dimethoxy-1-quinolin-6-ylethanamine?
The canonical SMILES for N-ethyl-2,2-dimethoxy-1-quinolin-6-ylethanamine is CCNC(c1ccc2ncccc2c1)C(OC)OC.
What is the InChIKey of N-ethyl-2,2-dimethoxy-1-quinolin-6-ylethanamine?
The InChIKey is MWDXXPDPIBAFAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-4-16-14(15(18-2)19-3)12-7-8-13-11(10-12)6-5-9-17-13/h5-10,14-16H,4H2,1-3H3.
What are the key properties of N-ethyl-2,2-dimethoxy-1-quinolin-6-ylethanamine?
N-ethyl-2,2-dimethoxy-1-quinolin-6-ylethanamine has a molecular weight of 260.34 g/mol, XLogP of 2.50, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,2-dimethoxy-1-quinolin-6-ylethanamine is sourced from PubChem (CID 81232075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).