N-[(2-aminophenyl)methyl]-N-ethylquinolin-2-amine

C18H19N3 — CID 60875708

IUPACN-[(2-aminophenyl)methyl]-N-ethylquinolin-2-amine
SMILESCCN(Cc1ccccc1N)c1ccc2ccccc2n1
InChIInChI=1S/C18H19N3/c1-2-21(13-15-8-3-5-9-16(15)19)18-12-11-14-7-4-6-10-17(14)20-18/h3-12H,2,13,19H2,1H3
InChIKeyAGPUHCQKIUBHNB-UHFFFAOYSA-N
MW277.37 g/mol
LogP3.84
Rot. Bonds4

About N-[(2-aminophenyl)methyl]-N-ethylquinolin-2-amine

N-[(2-aminophenyl)methyl]-N-ethylquinolin-2-amine (PubChem CID 60875708) has the molecular formula C18H19N3 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-[(2-aminophenyl)methyl]-N-ethylquinolin-2-amine.

Molecular Properties

Compound NameN-[(2-aminophenyl)methyl]-N-ethylquinolin-2-amine
PubChem CID60875708
Molecular FormulaC18H19N3
Molecular Weight277.37 g/mol
Exact Mass277.16
IUPAC NameN-[(2-aminophenyl)methyl]-N-ethylquinolin-2-amine
SMILESCCN(Cc1ccccc1N)c1ccc2ccccc2n1
InChIInChI=1S/C18H19N3/c1-2-21(13-15-8-3-5-9-16(15)19)18-12-11-14-7-4-6-10-17(14)20-18/h3-12H,2,13,19H2,1H3
InChIKeyAGPUHCQKIUBHNB-UHFFFAOYSA-N
XLogP3.84
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N,N-dibutylquinolin-2-amine
CID 125488581
2-N,2-N-diethylquinoline-2,8-diamine
CID 105469074
N-[(2-aminophenyl)methyl]-N-ethyl-5,6-dimethyl-1,2,4-triazin-3-amine
CID 114787292
N-[(2-aminophenyl)methyl]-N-ethylquinazolin-4-amine
CID 60894206
N-[(2-aminophenyl)methyl]-N-ethyl-5-fluoropyrimidin-2-amine
CID 113432149
2-[(2-aminophenyl)methyl-ethylamino]pyridine-4-carbonitrile
CID 60876115
N-[(4-aminophenyl)methyl]-N-methylquinolin-2-amine
CID 60875520
N-[(2-aminophenyl)methyl]-N-ethyl-3-methylpyrazin-2-amine
CID 83064268
N-[(2-aminophenyl)methyl]-N-ethyl-5-methyl-1,3,4-thiadiazol-2-amine
CID 65208770
3-N-ethyl-3-N-(quinolin-2-ylmethyl)benzene-1,3-diamine
CID 63229723
2-N-ethyl-2-N-[(2-methylphenyl)methyl]pyridine-2,3-diamine
CID 43587743
N-chloro-N-methylquinolin-2-amine
CID 87550890

Frequently Asked Questions

What is the IUPAC name of N-[(2-aminophenyl)methyl]-N-ethylquinolin-2-amine?
The IUPAC name of N-[(2-aminophenyl)methyl]-N-ethylquinolin-2-amine (CID 60875708) is N-[(2-aminophenyl)methyl]-N-ethylquinolin-2-amine.
What is the SMILES notation for N-[(2-aminophenyl)methyl]-N-ethylquinolin-2-amine?
The canonical SMILES for N-[(2-aminophenyl)methyl]-N-ethylquinolin-2-amine is CCN(Cc1ccccc1N)c1ccc2ccccc2n1.
What is the InChIKey of N-[(2-aminophenyl)methyl]-N-ethylquinolin-2-amine?
The InChIKey is AGPUHCQKIUBHNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3/c1-2-21(13-15-8-3-5-9-16(15)19)18-12-11-14-7-4-6-10-17(14)20-18/h3-12H,2,13,19H2,1H3.
What are the key properties of N-[(2-aminophenyl)methyl]-N-ethylquinolin-2-amine?
N-[(2-aminophenyl)methyl]-N-ethylquinolin-2-amine has a molecular weight of 277.37 g/mol, XLogP of 3.84, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-aminophenyl)methyl]-N-ethylquinolin-2-amine is sourced from PubChem (CID 60875708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).