2-[(7-aminoquinolin-4-yl)amino]-N-ethyl-N-methylpropanamide

C15H20N4O — CID 103106780

IUPAC2-[(7-aminoquinolin-4-yl)amino]-N-ethyl-N-methylpropanamide
SMILESCCN(C)C(=O)C(C)Nc1ccnc2cc(N)ccc12
InChIInChI=1S/C15H20N4O/c1-4-19(3)15(20)10(2)18-13-7-8-17-14-9-11(16)5-6-12(13)14/h5-10H,4,16H2,1-3H3,(H,17,18)
InChIKeyCJQISDAFROLBBL-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.10
Rot. Bonds4

About 2-[(7-aminoquinolin-4-yl)amino]-N-ethyl-N-methylpropanamide

2-[(7-aminoquinolin-4-yl)amino]-N-ethyl-N-methylpropanamide (PubChem CID 103106780) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 2-[(7-aminoquinolin-4-yl)amino]-N-ethyl-N-methylpropanamide.

Molecular Properties

Compound Name2-[(7-aminoquinolin-4-yl)amino]-N-ethyl-N-methylpropanamide
PubChem CID103106780
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name2-[(7-aminoquinolin-4-yl)amino]-N-ethyl-N-methylpropanamide
SMILESCCN(C)C(=O)C(C)Nc1ccnc2cc(N)ccc12
InChIInChI=1S/C15H20N4O/c1-4-19(3)15(20)10(2)18-13-7-8-17-14-9-11(16)5-6-12(13)14/h5-10H,4,16H2,1-3H3,(H,17,18)
InChIKeyCJQISDAFROLBBL-UHFFFAOYSA-N
XLogP2.10
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-[(6-chloroquinolin-4-yl)amino]-N-ethyl-N-methylpropanamide
CID 154839535
4-N-[2-(dimethylamino)propyl]quinoline-4,7-diamine
CID 103000943
2-[(7-bromo-1,5-naphthyridin-4-yl)amino]-N-ethyl-N-methylpropanamide
CID 103111680
4-N-[2-[ethyl(methyl)amino]ethyl]quinoline-4,7-diamine
CID 103001063
3-[(7-aminoquinolin-4-yl)amino]-N-butan-2-ylpropanamide
CID 103000927
2-[(2-chloro-4-pyridinyl)amino]-N-ethyl-N-methylpropanamide
CID 103112969
4-N-[3-[methyl(propan-2-yl)amino]propyl]quinoline-4,7-diamine
CID 106036752
N-ethyl-2-[(7-hydroxyisoquinolin-1-yl)amino]-N-methylpropanamide
CID 106540035
2-[(4-amino-2-pyridinyl)amino]-N,N-diethylpropanamide
CID 113408299
4-N-[1-(1,3-thiazol-2-yl)ethyl]quinoline-4,7-diamine
CID 103001288
3-[(7-aminoquinolin-4-yl)amino]-N-propylpropanamide
CID 103000936
2-[(4-amino-1,3-benzothiazol-5-yl)amino]-N-ethyl-N-methylpropanamide
CID 103106749

Frequently Asked Questions

What is the IUPAC name of 2-[(7-aminoquinolin-4-yl)amino]-N-ethyl-N-methylpropanamide?
The IUPAC name of 2-[(7-aminoquinolin-4-yl)amino]-N-ethyl-N-methylpropanamide (CID 103106780) is 2-[(7-aminoquinolin-4-yl)amino]-N-ethyl-N-methylpropanamide.
What is the SMILES notation for 2-[(7-aminoquinolin-4-yl)amino]-N-ethyl-N-methylpropanamide?
The canonical SMILES for 2-[(7-aminoquinolin-4-yl)amino]-N-ethyl-N-methylpropanamide is CCN(C)C(=O)C(C)Nc1ccnc2cc(N)ccc12.
What is the InChIKey of 2-[(7-aminoquinolin-4-yl)amino]-N-ethyl-N-methylpropanamide?
The InChIKey is CJQISDAFROLBBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-4-19(3)15(20)10(2)18-13-7-8-17-14-9-11(16)5-6-12(13)14/h5-10H,4,16H2,1-3H3,(H,17,18).
What are the key properties of 2-[(7-aminoquinolin-4-yl)amino]-N-ethyl-N-methylpropanamide?
2-[(7-aminoquinolin-4-yl)amino]-N-ethyl-N-methylpropanamide has a molecular weight of 272.35 g/mol, XLogP of 2.10, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(7-aminoquinolin-4-yl)amino]-N-ethyl-N-methylpropanamide is sourced from PubChem (CID 103106780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).