1-[4-(2-ethyl-5-methylpyrrolidin-1-yl)quinolin-2-yl]-N-methylmethanamine

C18H25N3 — CID 83220143

IUPAC1-[4-(2-ethyl-5-methylpyrrolidin-1-yl)quinolin-2-yl]-N-methylmethanamine
SMILESCCC1CCC(C)N1c1cc(CNC)nc2ccccc12
InChIInChI=1S/C18H25N3/c1-4-15-10-9-13(2)21(15)18-11-14(12-19-3)20-17-8-6-5-7-16(17)18/h5-8,11,13,15,19H,4,9-10,12H2,1-3H3
InChIKeyIHCMYDNSJHJCGX-UHFFFAOYSA-N
MW283.42 g/mol
LogP3.72
Rot. Bonds4

About 1-[4-(2-ethyl-5-methylpyrrolidin-1-yl)quinolin-2-yl]-N-methylmethanamine

1-[4-(2-ethyl-5-methylpyrrolidin-1-yl)quinolin-2-yl]-N-methylmethanamine (PubChem CID 83220143) has the molecular formula C18H25N3 and a molecular weight of 283.42 g/mol. Its IUPAC name is 1-[4-(2-ethyl-5-methylpyrrolidin-1-yl)quinolin-2-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[4-(2-ethyl-5-methylpyrrolidin-1-yl)quinolin-2-yl]-N-methylmethanamine
PubChem CID83220143
Molecular FormulaC18H25N3
Molecular Weight283.42 g/mol
Exact Mass283.20
IUPAC Name1-[4-(2-ethyl-5-methylpyrrolidin-1-yl)quinolin-2-yl]-N-methylmethanamine
SMILESCCC1CCC(C)N1c1cc(CNC)nc2ccccc12
InChIInChI=1S/C18H25N3/c1-4-15-10-9-13(2)21(15)18-11-14(12-19-3)20-17-8-6-5-7-16(17)18/h5-8,11,13,15,19H,4,9-10,12H2,1-3H3
InChIKeyIHCMYDNSJHJCGX-UHFFFAOYSA-N
XLogP3.72
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[4-(2-ethyl-5-methylpyrrolidin-1-yl)quinolin-2-yl]-N-methylmethanamine 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

CID 1935
CID 1935
CID 5281035
CID 5281035
CID 62344
CID 62344
CID 107838
CID 107838
CID 2993
CID 2993
CID 2723754
CID 2723754
CID 7019
CID 7019
CID 53389
CID 53389
CID 68802
CID 68802
CID 81116
CID 81116
CID 121896
CID 121896
CID 540335
CID 540335

Frequently Asked Questions

What is the IUPAC name of 1-[4-(2-ethyl-5-methylpyrrolidin-1-yl)quinolin-2-yl]-N-methylmethanamine?
The IUPAC name of 1-[4-(2-ethyl-5-methylpyrrolidin-1-yl)quinolin-2-yl]-N-methylmethanamine (CID 83220143) is 1-[4-(2-ethyl-5-methylpyrrolidin-1-yl)quinolin-2-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[4-(2-ethyl-5-methylpyrrolidin-1-yl)quinolin-2-yl]-N-methylmethanamine?
The canonical SMILES for 1-[4-(2-ethyl-5-methylpyrrolidin-1-yl)quinolin-2-yl]-N-methylmethanamine is CCC1CCC(C)N1c1cc(CNC)nc2ccccc12.
What is the InChIKey of 1-[4-(2-ethyl-5-methylpyrrolidin-1-yl)quinolin-2-yl]-N-methylmethanamine?
The InChIKey is IHCMYDNSJHJCGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3/c1-4-15-10-9-13(2)21(15)18-11-14(12-19-3)20-17-8-6-5-7-16(17)18/h5-8,11,13,15,19H,4,9-10,12H2,1-3H3.
What are the key properties of 1-[4-(2-ethyl-5-methylpyrrolidin-1-yl)quinolin-2-yl]-N-methylmethanamine?
1-[4-(2-ethyl-5-methylpyrrolidin-1-yl)quinolin-2-yl]-N-methylmethanamine has a molecular weight of 283.42 g/mol, XLogP of 3.72, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(2-ethyl-5-methylpyrrolidin-1-yl)quinolin-2-yl]-N-methylmethanamine is sourced from PubChem (CID 83220143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).