N-ethylquinolin-4-amine

C11H12N2 — CID 15306588

IUPACN-ethylquinolin-4-amine
SMILESCCNc1ccnc2ccccc12
InChIInChI=1S/C11H12N2/c1-2-12-11-7-8-13-10-6-4-3-5-9(10)11/h3-8H,2H2,1H3,(H,12,13)
InChIKeyTTXHGYGDDOYSDB-UHFFFAOYSA-N
MW172.23 g/mol
LogP2.67
Rot. Bonds2

About N-ethylquinolin-4-amine

N-ethylquinolin-4-amine (PubChem CID 15306588) has the molecular formula C11H12N2 and a molecular weight of 172.23 g/mol. Its IUPAC name is N-ethylquinolin-4-amine.

Molecular Properties

Compound NameN-ethylquinolin-4-amine
PubChem CID15306588
Molecular FormulaC11H12N2
Molecular Weight172.23 g/mol
Exact Mass172.10
IUPAC NameN-ethylquinolin-4-amine
SMILESCCNc1ccnc2ccccc12
InChIInChI=1S/C11H12N2/c1-2-12-11-7-8-13-10-6-4-3-5-9(10)11/h3-8H,2H2,1H3,(H,12,13)
InChIKeyTTXHGYGDDOYSDB-UHFFFAOYSA-N
XLogP2.67
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-ethylquinolin-4-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-methyl-N'-quinolin-4-ylethane-1,2-diamine
CID 62658935
N-(2-methylbutyl)quinolin-4-amine
CID 62694785
1-N-quinolin-4-ylbutane-1,2-diamine
CID 63730587
N-[[2-[(quinolin-4-ylamino)methyl]phenyl]methyl]quinolin-4-amine
CID 67723222
N-ethyl-7-methylquinolin-4-amine
CID 89060504
N-pentan-3-ylquinolin-4-amine
CID 61340263
N-(2,2-difluoroethyl)quinolin-4-amine
CID 79099279
1-(quinolin-4-ylamino)pentan-2-ol
CID 113234733
N-(2-chloro-3-ethylpentyl)quinolin-4-amine
CID 106287021
N-ethyl-6-phenoxyquinolin-4-amine
CID 63485387
3-N,3-N-diethyl-1-N-quinolin-4-ylbutane-1,3-diamine
CID 140608178
N-[(2-methylpyrimidin-4-yl)methyl]quinolin-4-amine
CID 61341548

Frequently Asked Questions

What is the IUPAC name of N-ethylquinolin-4-amine?
The IUPAC name of N-ethylquinolin-4-amine (CID 15306588) is N-ethylquinolin-4-amine.
What is the SMILES notation for N-ethylquinolin-4-amine?
The canonical SMILES for N-ethylquinolin-4-amine is CCNc1ccnc2ccccc12.
What is the InChIKey of N-ethylquinolin-4-amine?
The InChIKey is TTXHGYGDDOYSDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2/c1-2-12-11-7-8-13-10-6-4-3-5-9(10)11/h3-8H,2H2,1H3,(H,12,13).
What are the key properties of N-ethylquinolin-4-amine?
N-ethylquinolin-4-amine has a molecular weight of 172.23 g/mol, XLogP of 2.67, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethylquinolin-4-amine is sourced from PubChem (CID 15306588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).