3-[(cyclopropylamino)methyl]-N,N-diethylquinolin-2-amine

C17H23N3 — CID 43280349

IUPAC3-[(cyclopropylamino)methyl]-N,N-diethylquinolin-2-amine
SMILESCCN(CC)c1nc2ccccc2cc1CNC1CC1
InChIInChI=1S/C17H23N3/c1-3-20(4-2)17-14(12-18-15-9-10-15)11-13-7-5-6-8-16(13)19-17/h5-8,11,15,18H,3-4,9-10,12H2,1-2H3
InChIKeyCYWNACXIIJUJML-UHFFFAOYSA-N
MW269.39 g/mol
LogP3.33
Rot. Bonds6

About 3-[(cyclopropylamino)methyl]-N,N-diethylquinolin-2-amine

3-[(cyclopropylamino)methyl]-N,N-diethylquinolin-2-amine (PubChem CID 43280349) has the molecular formula C17H23N3 and a molecular weight of 269.39 g/mol. Its IUPAC name is 3-[(cyclopropylamino)methyl]-N,N-diethylquinolin-2-amine.

Molecular Properties

Compound Name3-[(cyclopropylamino)methyl]-N,N-diethylquinolin-2-amine
PubChem CID43280349
Molecular FormulaC17H23N3
Molecular Weight269.39 g/mol
Exact Mass269.19
IUPAC Name3-[(cyclopropylamino)methyl]-N,N-diethylquinolin-2-amine
SMILESCCN(CC)c1nc2ccccc2cc1CNC1CC1
InChIInChI=1S/C17H23N3/c1-3-20(4-2)17-14(12-18-15-9-10-15)11-13-7-5-6-8-16(13)19-17/h5-8,11,15,18H,3-4,9-10,12H2,1-2H3
InChIKeyCYWNACXIIJUJML-UHFFFAOYSA-N
XLogP3.33
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-3-[(cyclopropylamino)methyl]-N-methylquinolin-2-amine
CID 43281662
N,N-diethyl-3-(ethylaminomethyl)quinolin-2-amine
CID 43280352
2-[ethyl-[3-[(propan-2-ylamino)methyl]quinolin-2-yl]amino]ethanol
CID 60979986
N-[(2-piperidin-1-ylquinolin-3-yl)methyl]cyclopropanamine
CID 43281135
N-[(2-imidazol-1-ylquinolin-3-yl)methyl]cyclopropanamine
CID 43282124
N-[(2-thiomorpholin-4-ylquinolin-3-yl)methyl]cyclopropanamine
CID 43281437
4-[(cyclopropylamino)methyl]-N,N-dimethylquinolin-2-amine
CID 62279811
3-(chloromethyl)-N-cyclopentyl-N-ethylquinolin-2-amine
CID 43541407
3-(ethylaminomethyl)-N-methyl-N-[(2-methylcyclopropyl)methyl]quinolin-2-amine
CID 63864306
N-(cyclobutylmethyl)-3-[(cyclopropylamino)methyl]-N-ethylpyridin-2-amine
CID 107401850
N'-[3-(bromomethyl)quinolin-2-yl]-N'-ethyl-N,N-dimethylpropane-1,3-diamine
CID 107085501
N-(2-chloroethyl)-N-ethyl-3-methylquinolin-2-amine
CID 63392539

Frequently Asked Questions

What is the IUPAC name of 3-[(cyclopropylamino)methyl]-N,N-diethylquinolin-2-amine?
The IUPAC name of 3-[(cyclopropylamino)methyl]-N,N-diethylquinolin-2-amine (CID 43280349) is 3-[(cyclopropylamino)methyl]-N,N-diethylquinolin-2-amine.
What is the SMILES notation for 3-[(cyclopropylamino)methyl]-N,N-diethylquinolin-2-amine?
The canonical SMILES for 3-[(cyclopropylamino)methyl]-N,N-diethylquinolin-2-amine is CCN(CC)c1nc2ccccc2cc1CNC1CC1.
What is the InChIKey of 3-[(cyclopropylamino)methyl]-N,N-diethylquinolin-2-amine?
The InChIKey is CYWNACXIIJUJML-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3/c1-3-20(4-2)17-14(12-18-15-9-10-15)11-13-7-5-6-8-16(13)19-17/h5-8,11,15,18H,3-4,9-10,12H2,1-2H3.
What are the key properties of 3-[(cyclopropylamino)methyl]-N,N-diethylquinolin-2-amine?
3-[(cyclopropylamino)methyl]-N,N-diethylquinolin-2-amine has a molecular weight of 269.39 g/mol, XLogP of 3.33, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(cyclopropylamino)methyl]-N,N-diethylquinolin-2-amine is sourced from PubChem (CID 43280349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).