N-[(5-chloroquinolin-8-yl)methyl]-2-ethylcyclopropan-1-amine

C15H17ClN2 — CID 103765936

IUPACN-[(5-chloroquinolin-8-yl)methyl]-2-ethylcyclopropan-1-amine
SMILESCCC1CC1NCc1ccc(Cl)c2cccnc12
InChIInChI=1S/C15H17ClN2/c1-2-10-8-14(10)18-9-11-5-6-13(16)12-4-3-7-17-15(11)12/h3-7,10,14,18H,2,8-9H2,1H3
InChIKeyBHEMKPURSVAHFW-UHFFFAOYSA-N
MW260.77 g/mol
LogP3.78
Rot. Bonds4

About N-[(5-chloroquinolin-8-yl)methyl]-2-ethylcyclopropan-1-amine

N-[(5-chloroquinolin-8-yl)methyl]-2-ethylcyclopropan-1-amine (PubChem CID 103765936) has the molecular formula C15H17ClN2 and a molecular weight of 260.77 g/mol. Its IUPAC name is N-[(5-chloroquinolin-8-yl)methyl]-2-ethylcyclopropan-1-amine.

Molecular Properties

Compound NameN-[(5-chloroquinolin-8-yl)methyl]-2-ethylcyclopropan-1-amine
PubChem CID103765936
Molecular FormulaC15H17ClN2
Molecular Weight260.77 g/mol
Exact Mass260.11
IUPAC NameN-[(5-chloroquinolin-8-yl)methyl]-2-ethylcyclopropan-1-amine
SMILESCCC1CC1NCc1ccc(Cl)c2cccnc12
InChIInChI=1S/C15H17ClN2/c1-2-10-8-14(10)18-9-11-5-6-13(16)12-4-3-7-17-15(11)12/h3-7,10,14,18H,2,8-9H2,1H3
InChIKeyBHEMKPURSVAHFW-UHFFFAOYSA-N
XLogP3.78
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.77
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[(5-chloroquinolin-8-yl)methyl]-2-ethylcyclopropan-1-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-[(5-chloroquinolin-8-yl)methyl]-2-methylcyclohexan-1-amine
CID 115958999
N-[(5-chloroquinolin-8-yl)methyl]bicyclo[2.2.1]heptan-2-amine
CID 115697528
N-[(5-chloroquinolin-8-yl)methyl]-2-cyclopropyloxolan-3-amine
CID 103580673
(5-chloroquinolin-8-yl)methylhydrazine
CID 112617928
1-(5-chloroquinolin-8-yl)-N-ethoxymethanamine
CID 112686388
(2R)-N-[(5-chloroquinolin-8-yl)methyl]-1,1,1-trifluoro-2-methylbutan-2-amine
CID 95785918
4-[[(5-chloroquinolin-8-yl)methylamino]methyl]pyrrolidin-3-ol
CID 120962551
N-[(5-chloroquinolin-8-yl)methyl]-4-methylhexan-2-amine
CID 115959389
N-[(5-chloroquinolin-8-yl)methyl]-4-methylpiperazin-1-amine
CID 115959485
N-[(5-chloroquinolin-8-yl)methyl]-2,2-dimethyloxan-4-amine
CID 115764370
1-(5-chloroquinolin-8-yl)-N-[(3-methyl-2-pyridinyl)methyl]methanamine
CID 115697462
N-[(5-chloroquinolin-8-yl)methyl]but-3-yn-2-amine
CID 114415420

Frequently Asked Questions

What is the IUPAC name of N-[(5-chloroquinolin-8-yl)methyl]-2-ethylcyclopropan-1-amine?
The IUPAC name of N-[(5-chloroquinolin-8-yl)methyl]-2-ethylcyclopropan-1-amine (CID 103765936) is N-[(5-chloroquinolin-8-yl)methyl]-2-ethylcyclopropan-1-amine.
What is the SMILES notation for N-[(5-chloroquinolin-8-yl)methyl]-2-ethylcyclopropan-1-amine?
The canonical SMILES for N-[(5-chloroquinolin-8-yl)methyl]-2-ethylcyclopropan-1-amine is CCC1CC1NCc1ccc(Cl)c2cccnc12.
What is the InChIKey of N-[(5-chloroquinolin-8-yl)methyl]-2-ethylcyclopropan-1-amine?
The InChIKey is BHEMKPURSVAHFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN2/c1-2-10-8-14(10)18-9-11-5-6-13(16)12-4-3-7-17-15(11)12/h3-7,10,14,18H,2,8-9H2,1H3.
What are the key properties of N-[(5-chloroquinolin-8-yl)methyl]-2-ethylcyclopropan-1-amine?
N-[(5-chloroquinolin-8-yl)methyl]-2-ethylcyclopropan-1-amine has a molecular weight of 260.77 g/mol, XLogP of 3.78, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-chloroquinolin-8-yl)methyl]-2-ethylcyclopropan-1-amine is sourced from PubChem (CID 103765936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).