2-(methylaminomethyl)-N-propan-2-ylquinolin-4-amine

C14H19N3 — CID 113378137

IUPAC2-(methylaminomethyl)-N-propan-2-ylquinolin-4-amine
SMILESCNCc1cc(NC(C)C)c2ccccc2n1
InChIInChI=1S/C14H19N3/c1-10(2)16-14-8-11(9-15-3)17-13-7-5-4-6-12(13)14/h4-8,10,15H,9H2,1-3H3,(H,16,17)
InChIKeyNZBSOCKOZBEEIE-UHFFFAOYSA-N
MW229.33 g/mol
LogP2.77
Rot. Bonds4

About 2-(methylaminomethyl)-N-propan-2-ylquinolin-4-amine

2-(methylaminomethyl)-N-propan-2-ylquinolin-4-amine (PubChem CID 113378137) has the molecular formula C14H19N3 and a molecular weight of 229.33 g/mol. Its IUPAC name is 2-(methylaminomethyl)-N-propan-2-ylquinolin-4-amine.

Molecular Properties

Compound Name2-(methylaminomethyl)-N-propan-2-ylquinolin-4-amine
PubChem CID113378137
Molecular FormulaC14H19N3
Molecular Weight229.33 g/mol
Exact Mass229.16
IUPAC Name2-(methylaminomethyl)-N-propan-2-ylquinolin-4-amine
SMILESCNCc1cc(NC(C)C)c2ccccc2n1
InChIInChI=1S/C14H19N3/c1-10(2)16-14-8-11(9-15-3)17-13-7-5-4-6-12(13)14/h4-8,10,15H,9H2,1-3H3,(H,16,17)
InChIKeyNZBSOCKOZBEEIE-UHFFFAOYSA-N
XLogP2.77
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.33
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(aminomethyl)-N-propan-2-ylquinolin-4-amine
CID 84681230
N-methyl-1-[4-(2-methylpropoxy)quinolin-2-yl]methanamine
CID 63377132
1-[4-(azepan-1-yl)quinolin-2-yl]-N-methylmethanamine
CID 63374160
N-cyclopropyl-N-methyl-2-(methylaminomethyl)quinolin-4-amine
CID 55183416
N-ethyl-4-(methylaminomethyl)-N-propan-2-ylquinolin-2-amine
CID 62281272
N-methyl-1-[4-(2-methylbutan-2-yloxy)quinolin-2-yl]methanamine
CID 63377272
N-methyl-1-[4-(4-methylpiperidin-1-yl)quinolin-2-yl]methanamine
CID 63374156
1-[4-(2-ethoxyethoxy)quinolin-2-yl]-N-methylmethanamine
CID 63377669
N-(4-chloro-3-methylbutan-2-yl)-2-methylquinolin-4-amine
CID 113484976
1-[4-(4-ethylpiperazin-1-yl)quinolin-2-yl]-N-methylmethanamine
CID 63374122
N-[(4-but-2-enoxyquinolin-2-yl)methyl]propan-2-amine
CID 76995835
N-propan-2-ylcinnolin-4-amine
CID 39733520

Frequently Asked Questions

What is the IUPAC name of 2-(methylaminomethyl)-N-propan-2-ylquinolin-4-amine?
The IUPAC name of 2-(methylaminomethyl)-N-propan-2-ylquinolin-4-amine (CID 113378137) is 2-(methylaminomethyl)-N-propan-2-ylquinolin-4-amine.
What is the SMILES notation for 2-(methylaminomethyl)-N-propan-2-ylquinolin-4-amine?
The canonical SMILES for 2-(methylaminomethyl)-N-propan-2-ylquinolin-4-amine is CNCc1cc(NC(C)C)c2ccccc2n1.
What is the InChIKey of 2-(methylaminomethyl)-N-propan-2-ylquinolin-4-amine?
The InChIKey is NZBSOCKOZBEEIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3/c1-10(2)16-14-8-11(9-15-3)17-13-7-5-4-6-12(13)14/h4-8,10,15H,9H2,1-3H3,(H,16,17).
What are the key properties of 2-(methylaminomethyl)-N-propan-2-ylquinolin-4-amine?
2-(methylaminomethyl)-N-propan-2-ylquinolin-4-amine has a molecular weight of 229.33 g/mol, XLogP of 2.77, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylaminomethyl)-N-propan-2-ylquinolin-4-amine is sourced from PubChem (CID 113378137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).