N-ethyl-2-(3-methylquinolin-6-yl)ethanamine

C14H18N2 — CID 116997407

IUPACN-ethyl-2-(3-methylquinolin-6-yl)ethanamine
SMILESCCNCCc1ccc2ncc(C)cc2c1
InChIInChI=1S/C14H18N2/c1-3-15-7-6-12-4-5-14-13(9-12)8-11(2)10-16-14/h4-5,8-10,15H,3,6-7H2,1-2H3
InChIKeyPZIBWLGRSVUFBZ-UHFFFAOYSA-N
MW214.31 g/mol
LogP2.70
Rot. Bonds4

About N-ethyl-2-(3-methylquinolin-6-yl)ethanamine

N-ethyl-2-(3-methylquinolin-6-yl)ethanamine (PubChem CID 116997407) has the molecular formula C14H18N2 and a molecular weight of 214.31 g/mol. Its IUPAC name is N-ethyl-2-(3-methylquinolin-6-yl)ethanamine.

Molecular Properties

Compound NameN-ethyl-2-(3-methylquinolin-6-yl)ethanamine
PubChem CID116997407
Molecular FormulaC14H18N2
Molecular Weight214.31 g/mol
Exact Mass214.15
IUPAC NameN-ethyl-2-(3-methylquinolin-6-yl)ethanamine
SMILESCCNCCc1ccc2ncc(C)cc2c1
InChIInChI=1S/C14H18N2/c1-3-15-7-6-12-4-5-14-13(9-12)8-11(2)10-16-14/h4-5,8-10,15H,3,6-7H2,1-2H3
InChIKeyPZIBWLGRSVUFBZ-UHFFFAOYSA-N
XLogP2.70
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

6-(2-chloroethyl)-3-methylquinoline
CID 116997430
2-(2-chloro-3-methylquinolin-6-yl)-N-ethylethanamine
CID 116997857
2-methyl-4-(3-methylquinolin-6-yl)butan-2-ol
CID 177184332
3-(3-methylquinolin-6-yl)propanoic acid
CID 83886586
4-(3-methylquinolin-6-yl)butan-2-amine
CID 116997396
N-ethyl-2-(2-methyl-1,3-benzothiazol-6-yl)ethanamine
CID 116999819
3,6-diethylquinoline
CID 82111628
1-(3-methylquinolin-6-yl)propan-2-amine
CID 83880771
N-[(3-methylquinolin-6-yl)methyl]cyclopropanamine
CID 116997781
N-ethyl-2-(5-methyl-3-pyridinyl)ethanamine
CID 115375184
3-(bromomethyl)-6-propylquinoline
CID 95733005
2-ethylnaphthalene;3-methylquinoline
CID 143066870

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(3-methylquinolin-6-yl)ethanamine?
The IUPAC name of N-ethyl-2-(3-methylquinolin-6-yl)ethanamine (CID 116997407) is N-ethyl-2-(3-methylquinolin-6-yl)ethanamine.
What is the SMILES notation for N-ethyl-2-(3-methylquinolin-6-yl)ethanamine?
The canonical SMILES for N-ethyl-2-(3-methylquinolin-6-yl)ethanamine is CCNCCc1ccc2ncc(C)cc2c1.
What is the InChIKey of N-ethyl-2-(3-methylquinolin-6-yl)ethanamine?
The InChIKey is PZIBWLGRSVUFBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2/c1-3-15-7-6-12-4-5-14-13(9-12)8-11(2)10-16-14/h4-5,8-10,15H,3,6-7H2,1-2H3.
What are the key properties of N-ethyl-2-(3-methylquinolin-6-yl)ethanamine?
N-ethyl-2-(3-methylquinolin-6-yl)ethanamine has a molecular weight of 214.31 g/mol, XLogP of 2.70, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(3-methylquinolin-6-yl)ethanamine is sourced from PubChem (CID 116997407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).