N'-ethyl-N'-[(2-methylquinolin-6-yl)methyl]ethane-1,2-diamine

C15H21N3 — CID 114231068

IUPACN'-ethyl-N'-[(2-methylquinolin-6-yl)methyl]ethane-1,2-diamine
SMILESCCN(CCN)Cc1ccc2nc(C)ccc2c1
InChIInChI=1S/C15H21N3/c1-3-18(9-8-16)11-13-5-7-15-14(10-13)6-4-12(2)17-15/h4-7,10H,3,8-9,11,16H2,1-2H3
InChIKeyYIFDTGNYOWOBPZ-UHFFFAOYSA-N
MW243.35 g/mol
LogP2.32
Rot. Bonds5

About N'-ethyl-N'-[(2-methylquinolin-6-yl)methyl]ethane-1,2-diamine

N'-ethyl-N'-[(2-methylquinolin-6-yl)methyl]ethane-1,2-diamine (PubChem CID 114231068) has the molecular formula C15H21N3 and a molecular weight of 243.35 g/mol. Its IUPAC name is N'-ethyl-N'-[(2-methylquinolin-6-yl)methyl]ethane-1,2-diamine.

Molecular Properties

Compound NameN'-ethyl-N'-[(2-methylquinolin-6-yl)methyl]ethane-1,2-diamine
PubChem CID114231068
Molecular FormulaC15H21N3
Molecular Weight243.35 g/mol
Exact Mass243.17
IUPAC NameN'-ethyl-N'-[(2-methylquinolin-6-yl)methyl]ethane-1,2-diamine
SMILESCCN(CCN)Cc1ccc2nc(C)ccc2c1
InChIInChI=1S/C15H21N3/c1-3-18(9-8-16)11-13-5-7-15-14(10-13)6-4-12(2)17-15/h4-7,10H,3,8-9,11,16H2,1-2H3
InChIKeyYIFDTGNYOWOBPZ-UHFFFAOYSA-N
XLogP2.32
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N'-ethyl-N'-[(2-methylquinolin-6-yl)methyl]ethane-1,2-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N'-(3H-benzimidazol-5-ylmethyl)-N'-ethylethane-1,2-diamine
CID 103102145
N'-[(4-chloro-3-methylphenyl)methyl]-N'-ethylethane-1,2-diamine
CID 103102286
N'-ethyl-N'-(1H-indol-6-ylmethyl)ethane-1,2-diamine
CID 103102150
(2-methylquinolin-6-yl)methanethiol
CID 105379811
N'-[(3,5-dimethylphenyl)methyl]-N'-ethylethane-1,2-diamine
CID 61348360
N'-ethyl-N'-[(3-methoxy-4-methylphenyl)methyl]ethane-1,2-diamine
CID 103102095
4-N-methyl-4-N-[(2-methylquinolin-6-yl)methyl]cyclohexane-1,4-diamine
CID 105379010
N'-[(4-bromophenyl)methyl]-N'-ethylethane-1,2-diamine
CID 66568273
N,N-diethyl-2-methylquinolin-6-amine
CID 23464022
trimethyl-[(2-methylquinolin-6-yl)methyl]silane
CID 134953516
6-(3-bromopropyl)-2-methylquinoline
CID 81221400
2-[methyl-[(2-methylquinolin-6-yl)methyl]amino]acetic acid
CID 105379644

Frequently Asked Questions

What is the IUPAC name of N'-ethyl-N'-[(2-methylquinolin-6-yl)methyl]ethane-1,2-diamine?
The IUPAC name of N'-ethyl-N'-[(2-methylquinolin-6-yl)methyl]ethane-1,2-diamine (CID 114231068) is N'-ethyl-N'-[(2-methylquinolin-6-yl)methyl]ethane-1,2-diamine.
What is the SMILES notation for N'-ethyl-N'-[(2-methylquinolin-6-yl)methyl]ethane-1,2-diamine?
The canonical SMILES for N'-ethyl-N'-[(2-methylquinolin-6-yl)methyl]ethane-1,2-diamine is CCN(CCN)Cc1ccc2nc(C)ccc2c1.
What is the InChIKey of N'-ethyl-N'-[(2-methylquinolin-6-yl)methyl]ethane-1,2-diamine?
The InChIKey is YIFDTGNYOWOBPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3/c1-3-18(9-8-16)11-13-5-7-15-14(10-13)6-4-12(2)17-15/h4-7,10H,3,8-9,11,16H2,1-2H3.
What are the key properties of N'-ethyl-N'-[(2-methylquinolin-6-yl)methyl]ethane-1,2-diamine?
N'-ethyl-N'-[(2-methylquinolin-6-yl)methyl]ethane-1,2-diamine has a molecular weight of 243.35 g/mol, XLogP of 2.32, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethyl-N'-[(2-methylquinolin-6-yl)methyl]ethane-1,2-diamine is sourced from PubChem (CID 114231068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).