N-[(1-methylcyclopropyl)-quinolin-5-ylmethyl]ethanamine

C16H20N2 — CID 81232158

IUPACN-[(1-methylcyclopropyl)-quinolin-5-ylmethyl]ethanamine
SMILESCCNC(c1cccc2ncccc12)C1(C)CC1
InChIInChI=1S/C16H20N2/c1-3-17-15(16(2)9-10-16)13-6-4-8-14-12(13)7-5-11-18-14/h4-8,11,15,17H,3,9-10H2,1-2H3
InChIKeyMVBZZHOEPKZZRF-UHFFFAOYSA-N
MW240.35 g/mol
LogP3.69
Rot. Bonds4

About N-[(1-methylcyclopropyl)-quinolin-5-ylmethyl]ethanamine

N-[(1-methylcyclopropyl)-quinolin-5-ylmethyl]ethanamine (PubChem CID 81232158) has the molecular formula C16H20N2 and a molecular weight of 240.35 g/mol. Its IUPAC name is N-[(1-methylcyclopropyl)-quinolin-5-ylmethyl]ethanamine.

Molecular Properties

Compound NameN-[(1-methylcyclopropyl)-quinolin-5-ylmethyl]ethanamine
PubChem CID81232158
Molecular FormulaC16H20N2
Molecular Weight240.35 g/mol
Exact Mass240.16
IUPAC NameN-[(1-methylcyclopropyl)-quinolin-5-ylmethyl]ethanamine
SMILESCCNC(c1cccc2ncccc12)C1(C)CC1
InChIInChI=1S/C16H20N2/c1-3-17-15(16(2)9-10-16)13-6-4-8-14-12(13)7-5-11-18-14/h4-8,11,15,17H,3,9-10H2,1-2H3
InChIKeyMVBZZHOEPKZZRF-UHFFFAOYSA-N
XLogP3.69
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[(1-methylcyclopropyl)-quinolin-5-ylmethyl]ethanamine 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-ethyl-1-quinolin-5-ylprop-2-yn-1-amine
CID 105158296
N-[pyridin-2-yl(quinolin-5-yl)methyl]ethanamine
CID 81220016
N-ethyl-1-quinolin-5-ylpentan-1-amine
CID 81231643
N,3-diethyl-1-quinolin-5-ylpentan-1-amine
CID 105176769
N-ethyl-2,2-dimethoxy-1-quinolin-5-ylethanamine
CID 81231933
N-[furan-3-yl(quinolin-5-yl)methyl]ethanamine
CID 81232108
N-[(5-methylpyrazin-2-yl)-quinolin-5-ylmethyl]ethanamine
CID 105172000
N-ethyl-1-quinolin-5-ylhexan-1-amine
CID 105020078
N-[isoquinolin-5-yl-(1-methylcyclohexyl)methyl]ethanamine
CID 106830050
N-[pyrimidin-4-yl(quinolin-5-yl)methyl]ethanamine
CID 81231393
N-[(1-ethylpyrazol-4-yl)-quinolin-5-ylmethyl]ethanamine
CID 105108998
N-[(1-methylcyclopentyl)-quinolin-7-ylmethyl]ethanamine
CID 105021674

Frequently Asked Questions

What is the IUPAC name of N-[(1-methylcyclopropyl)-quinolin-5-ylmethyl]ethanamine?
The IUPAC name of N-[(1-methylcyclopropyl)-quinolin-5-ylmethyl]ethanamine (CID 81232158) is N-[(1-methylcyclopropyl)-quinolin-5-ylmethyl]ethanamine.
What is the SMILES notation for N-[(1-methylcyclopropyl)-quinolin-5-ylmethyl]ethanamine?
The canonical SMILES for N-[(1-methylcyclopropyl)-quinolin-5-ylmethyl]ethanamine is CCNC(c1cccc2ncccc12)C1(C)CC1.
What is the InChIKey of N-[(1-methylcyclopropyl)-quinolin-5-ylmethyl]ethanamine?
The InChIKey is MVBZZHOEPKZZRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2/c1-3-17-15(16(2)9-10-16)13-6-4-8-14-12(13)7-5-11-18-14/h4-8,11,15,17H,3,9-10H2,1-2H3.
What are the key properties of N-[(1-methylcyclopropyl)-quinolin-5-ylmethyl]ethanamine?
N-[(1-methylcyclopropyl)-quinolin-5-ylmethyl]ethanamine has a molecular weight of 240.35 g/mol, XLogP of 3.69, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methylcyclopropyl)-quinolin-5-ylmethyl]ethanamine is sourced from PubChem (CID 81232158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).