2-(6-amino-3,4-dihydro-2H-quinolin-1-yl)-N-cyclopropyl-N-methylacetamide

C15H21N3O — CID 61489538

IUPAC2-(6-amino-3,4-dihydro-2H-quinolin-1-yl)-N-cyclopropyl-N-methylacetamide
SMILESCN(C(=O)CN1CCCc2cc(N)ccc21)C1CC1
InChIInChI=1S/C15H21N3O/c1-17(13-5-6-13)15(19)10-18-8-2-3-11-9-12(16)4-7-14(11)18/h4,7,9,13H,2-3,5-6,8,10,16H2,1H3
InChIKeyMMIHPHWFBIIRHQ-UHFFFAOYSA-N
MW259.35 g/mol
LogP1.64
Rot. Bonds3

About 2-(6-amino-3,4-dihydro-2H-quinolin-1-yl)-N-cyclopropyl-N-methylacetamide

2-(6-amino-3,4-dihydro-2H-quinolin-1-yl)-N-cyclopropyl-N-methylacetamide (PubChem CID 61489538) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is 2-(6-amino-3,4-dihydro-2H-quinolin-1-yl)-N-cyclopropyl-N-methylacetamide.

Molecular Properties

Compound Name2-(6-amino-3,4-dihydro-2H-quinolin-1-yl)-N-cyclopropyl-N-methylacetamide
PubChem CID61489538
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC Name2-(6-amino-3,4-dihydro-2H-quinolin-1-yl)-N-cyclopropyl-N-methylacetamide
SMILESCN(C(=O)CN1CCCc2cc(N)ccc21)C1CC1
InChIInChI=1S/C15H21N3O/c1-17(13-5-6-13)15(19)10-18-8-2-3-11-9-12(16)4-7-14(11)18/h4,7,9,13H,2-3,5-6,8,10,16H2,1H3
InChIKeyMMIHPHWFBIIRHQ-UHFFFAOYSA-N
XLogP1.64
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

ethyl 2-(6-amino-3,4-dihydro-2H-quinolin-1-yl)acetate
CID 60735402
2-(5-amino-3,4-dihydro-2H-quinolin-1-yl)-N-cyclopropyl-N-methylacetamide
CID 61489284
2-(7-amino-3,4-dihydro-2H-quinolin-1-yl)-N,N-diethylacetamide
CID 62266731
N-cyclopropyl-N-methyl-2-[5-[1-(methylamino)ethyl]-2,3-dihydroindol-1-yl]acetamide
CID 102661728
1-(3-methylbut-3-enyl)-3,4-dihydro-2H-quinolin-6-amine
CID 114473358
2-(6-amino-3,4-dihydro-2H-quinolin-1-yl)ethanethiol
CID 59090152
2-(6-amino-3,4-dihydro-2H-quinolin-1-yl)-N-(2-methylphenyl)acetamide
CID 43823754
2-(7-amino-2-methyl-3-oxo-1,4-benzoxazin-4-yl)-N-cyclopropyl-N-methylacetamide
CID 62988767
6-(6-amino-3,4-dihydro-2H-quinolin-1-yl)hexan-1-ol
CID 107704010
1-(3,3-dimethylbutyl)-3,4-dihydro-2H-quinolin-6-amine
CID 54957573
2-(6-amino-2-oxo-3,4-dihydroquinolin-1-yl)-N-cyclopropyl-N-ethylacetamide
CID 61488262
1-(1-ethyl-3,4-dihydro-2H-quinolin-6-yl)propan-1-one
CID 39104414

Frequently Asked Questions

What is the IUPAC name of 2-(6-amino-3,4-dihydro-2H-quinolin-1-yl)-N-cyclopropyl-N-methylacetamide?
The IUPAC name of 2-(6-amino-3,4-dihydro-2H-quinolin-1-yl)-N-cyclopropyl-N-methylacetamide (CID 61489538) is 2-(6-amino-3,4-dihydro-2H-quinolin-1-yl)-N-cyclopropyl-N-methylacetamide.
What is the SMILES notation for 2-(6-amino-3,4-dihydro-2H-quinolin-1-yl)-N-cyclopropyl-N-methylacetamide?
The canonical SMILES for 2-(6-amino-3,4-dihydro-2H-quinolin-1-yl)-N-cyclopropyl-N-methylacetamide is CN(C(=O)CN1CCCc2cc(N)ccc21)C1CC1.
What is the InChIKey of 2-(6-amino-3,4-dihydro-2H-quinolin-1-yl)-N-cyclopropyl-N-methylacetamide?
The InChIKey is MMIHPHWFBIIRHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c1-17(13-5-6-13)15(19)10-18-8-2-3-11-9-12(16)4-7-14(11)18/h4,7,9,13H,2-3,5-6,8,10,16H2,1H3.
What are the key properties of 2-(6-amino-3,4-dihydro-2H-quinolin-1-yl)-N-cyclopropyl-N-methylacetamide?
2-(6-amino-3,4-dihydro-2H-quinolin-1-yl)-N-cyclopropyl-N-methylacetamide has a molecular weight of 259.35 g/mol, XLogP of 1.64, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-amino-3,4-dihydro-2H-quinolin-1-yl)-N-cyclopropyl-N-methylacetamide is sourced from PubChem (CID 61489538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).