N-cyclopropyl-N-methyl-2-(methylaminomethyl)quinolin-4-amine

C15H19N3 — CID 55183416

IUPACN-cyclopropyl-N-methyl-2-(methylaminomethyl)quinolin-4-amine
SMILESCNCc1cc(N(C)C2CC2)c2ccccc2n1
InChIInChI=1S/C15H19N3/c1-16-10-11-9-15(18(2)12-7-8-12)13-5-3-4-6-14(13)17-11/h3-6,9,12,16H,7-8,10H2,1-2H3
InChIKeyCWDFHDJPXWYGLP-UHFFFAOYSA-N
MW241.34 g/mol
LogP2.55
Rot. Bonds4

About N-cyclopropyl-N-methyl-2-(methylaminomethyl)quinolin-4-amine

N-cyclopropyl-N-methyl-2-(methylaminomethyl)quinolin-4-amine (PubChem CID 55183416) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is N-cyclopropyl-N-methyl-2-(methylaminomethyl)quinolin-4-amine.

Molecular Properties

Compound NameN-cyclopropyl-N-methyl-2-(methylaminomethyl)quinolin-4-amine
PubChem CID55183416
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC NameN-cyclopropyl-N-methyl-2-(methylaminomethyl)quinolin-4-amine
SMILESCNCc1cc(N(C)C2CC2)c2ccccc2n1
InChIInChI=1S/C15H19N3/c1-16-10-11-9-15(18(2)12-7-8-12)13-5-3-4-6-14(13)17-11/h3-6,9,12,16H,7-8,10H2,1-2H3
InChIKeyCWDFHDJPXWYGLP-UHFFFAOYSA-N
XLogP2.55
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-methyl-2-(methylaminomethyl)quinolin-4-amine?
The IUPAC name of N-cyclopropyl-N-methyl-2-(methylaminomethyl)quinolin-4-amine (CID 55183416) is N-cyclopropyl-N-methyl-2-(methylaminomethyl)quinolin-4-amine.
What is the SMILES notation for N-cyclopropyl-N-methyl-2-(methylaminomethyl)quinolin-4-amine?
The canonical SMILES for N-cyclopropyl-N-methyl-2-(methylaminomethyl)quinolin-4-amine is CNCc1cc(N(C)C2CC2)c2ccccc2n1.
What is the InChIKey of N-cyclopropyl-N-methyl-2-(methylaminomethyl)quinolin-4-amine?
The InChIKey is CWDFHDJPXWYGLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-16-10-11-9-15(18(2)12-7-8-12)13-5-3-4-6-14(13)17-11/h3-6,9,12,16H,7-8,10H2,1-2H3.
What are the key properties of N-cyclopropyl-N-methyl-2-(methylaminomethyl)quinolin-4-amine?
N-cyclopropyl-N-methyl-2-(methylaminomethyl)quinolin-4-amine has a molecular weight of 241.34 g/mol, XLogP of 2.55, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-methyl-2-(methylaminomethyl)quinolin-4-amine is sourced from PubChem (CID 55183416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).