4-(aminomethyl)-N,N-dimethylquinolin-2-amine

C12H15N3 — CID 56828443

IUPAC4-(aminomethyl)-N,N-dimethylquinolin-2-amine
SMILESCN(C)c1cc(CN)c2ccccc2n1
InChIInChI=1S/C12H15N3/c1-15(2)12-7-9(8-13)10-5-3-4-6-11(10)14-12/h3-7H,8,13H2,1-2H3
InChIKeyDITYDNHMDFIHEA-UHFFFAOYSA-N
MW201.27 g/mol
LogP1.76
Rot. Bonds2

About 4-(aminomethyl)-N,N-dimethylquinolin-2-amine

4-(aminomethyl)-N,N-dimethylquinolin-2-amine (PubChem CID 56828443) has the molecular formula C12H15N3 and a molecular weight of 201.27 g/mol. Its IUPAC name is 4-(aminomethyl)-N,N-dimethylquinolin-2-amine.

Molecular Properties

Compound Name4-(aminomethyl)-N,N-dimethylquinolin-2-amine
PubChem CID56828443
Molecular FormulaC12H15N3
Molecular Weight201.27 g/mol
Exact Mass201.13
IUPAC Name4-(aminomethyl)-N,N-dimethylquinolin-2-amine
SMILESCN(C)c1cc(CN)c2ccccc2n1
InChIInChI=1S/C12H15N3/c1-15(2)12-7-9(8-13)10-5-3-4-6-11(10)14-12/h3-7H,8,13H2,1-2H3
InChIKeyDITYDNHMDFIHEA-UHFFFAOYSA-N
XLogP1.76
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(aminomethyl)-N,N-diethylquinolin-2-amine
CID 62299448
4-(aminomethyl)-N-methyl-N-propylquinolin-2-amine
CID 62300858
4-(aminomethyl)-N-(2-methoxyethyl)-N-methylquinolin-2-amine
CID 62285875
4-(aminomethyl)-N-methyl-N-(1-methylpiperidin-4-yl)quinolin-2-amine
CID 62300001
4-(aminomethyl)-N-(3-methoxypropyl)-N-methylquinolin-2-amine
CID 63008304
2-amino-4-[2-(dimethylamino)quinolin-4-yl]butan-1-ol
CID 144525418
(2-methylquinolin-4-yl)methanamine;dihydrochloride
CID 42946478
4-(aminomethyl)-N-cyclopropyl-N-propylquinolin-2-amine
CID 62299647
4-[[2-(dimethylamino)quinolin-4-yl]methyl]benzaldehyde
CID 22282606
4-[(cyclopropylamino)methyl]-N,N-dimethylquinolin-2-amine
CID 62279811
2-N,2-N,4-N-trimethylquinoline-2,4-diamine
CID 14338127
4-(aminomethyl)-N-(cyclobutylmethyl)-N-ethylquinolin-2-amine
CID 107397272

Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-N,N-dimethylquinolin-2-amine?
The IUPAC name of 4-(aminomethyl)-N,N-dimethylquinolin-2-amine (CID 56828443) is 4-(aminomethyl)-N,N-dimethylquinolin-2-amine.
What is the SMILES notation for 4-(aminomethyl)-N,N-dimethylquinolin-2-amine?
The canonical SMILES for 4-(aminomethyl)-N,N-dimethylquinolin-2-amine is CN(C)c1cc(CN)c2ccccc2n1.
What is the InChIKey of 4-(aminomethyl)-N,N-dimethylquinolin-2-amine?
The InChIKey is DITYDNHMDFIHEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3/c1-15(2)12-7-9(8-13)10-5-3-4-6-11(10)14-12/h3-7H,8,13H2,1-2H3.
What are the key properties of 4-(aminomethyl)-N,N-dimethylquinolin-2-amine?
4-(aminomethyl)-N,N-dimethylquinolin-2-amine has a molecular weight of 201.27 g/mol, XLogP of 1.76, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-N,N-dimethylquinolin-2-amine is sourced from PubChem (CID 56828443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).