N-chloro-N-methylquinolin-2-amine

C10H9ClN2 — CID 87550890

IUPACN-chloro-N-methylquinolin-2-amine
SMILESCN(Cl)c1ccc2ccccc2n1
InChIInChI=1S/C10H9ClN2/c1-13(11)10-7-6-8-4-2-3-5-9(8)12-10/h2-7H,1H3
InChIKeyONUJMQSMFFMAKJ-UHFFFAOYSA-N
MW192.65 g/mol
LogP2.82
Rot. Bonds1

About N-chloro-N-methylquinolin-2-amine

N-chloro-N-methylquinolin-2-amine (PubChem CID 87550890) has the molecular formula C10H9ClN2 and a molecular weight of 192.65 g/mol. Its IUPAC name is N-chloro-N-methylquinolin-2-amine.

Molecular Properties

Compound NameN-chloro-N-methylquinolin-2-amine
PubChem CID87550890
Molecular FormulaC10H9ClN2
Molecular Weight192.65 g/mol
Exact Mass192.05
IUPAC NameN-chloro-N-methylquinolin-2-amine
SMILESCN(Cl)c1ccc2ccccc2n1
InChIInChI=1S/C10H9ClN2/c1-13(11)10-7-6-8-4-2-3-5-9(8)12-10/h2-7H,1H3
InChIKeyONUJMQSMFFMAKJ-UHFFFAOYSA-N
XLogP2.82
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.65
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-chloro-N-methylquinolin-2-amine 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,N-dibromoquinolin-2-amine;dihydrate
CID 174663380
N-methyl-N-naphthalen-2-ylquinolin-2-amine
CID 70891325
N-methyl-N-(3-methylbutyl)quinolin-2-amine
CID 175306450
N,N-dibutylquinolin-2-amine
CID 125488581
N-(2-cyclopropylethyl)-N-methylquinolin-2-amine
CID 133398513
N-phenyl-N-propan-2-ylquinolin-2-amine
CID 59282154
1-phenyl-1-quinolin-2-ylhydrazine
CID 176877682
N-[(4-aminophenyl)methyl]-N-methylquinolin-2-amine
CID 60875520
3-N-methyl-3-N-quinolin-2-ylbutane-1,3-diamine
CID 63225623
N,N-dimethylquinolin-2-amine;ethyl formate
CID 173137304
4-[methyl(quinolin-2-yl)amino]butanoic acid
CID 43329714
N-methyl-N-(2-pyrrolidin-1-ylethyl)quinolin-2-amine
CID 153322955

Frequently Asked Questions

What is the IUPAC name of N-chloro-N-methylquinolin-2-amine?
The IUPAC name of N-chloro-N-methylquinolin-2-amine (CID 87550890) is N-chloro-N-methylquinolin-2-amine.
What is the SMILES notation for N-chloro-N-methylquinolin-2-amine?
The canonical SMILES for N-chloro-N-methylquinolin-2-amine is CN(Cl)c1ccc2ccccc2n1.
What is the InChIKey of N-chloro-N-methylquinolin-2-amine?
The InChIKey is ONUJMQSMFFMAKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClN2/c1-13(11)10-7-6-8-4-2-3-5-9(8)12-10/h2-7H,1H3.
What are the key properties of N-chloro-N-methylquinolin-2-amine?
N-chloro-N-methylquinolin-2-amine has a molecular weight of 192.65 g/mol, XLogP of 2.82, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-chloro-N-methylquinolin-2-amine is sourced from PubChem (CID 87550890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).