(8-amino-3,4-dihydro-2H-quinolin-1-yl)-(furan-2-yl)methanone

C14H14N2O2 — CID 82084861

IUPAC(8-amino-3,4-dihydro-2H-quinolin-1-yl)-(furan-2-yl)methanone
SMILESNc1cccc2c1N(C(=O)c1ccco1)CCC2
InChIInChI=1S/C14H14N2O2/c15-11-6-1-4-10-5-2-8-16(13(10)11)14(17)12-7-3-9-18-12/h1,3-4,6-7,9H,2,5,8,15H2
InChIKeyWRSNCMPQLHLLLO-UHFFFAOYSA-N
MW242.28 g/mol
LogP2.45
Rot. Bonds1

About (8-amino-3,4-dihydro-2H-quinolin-1-yl)-(furan-2-yl)methanone

(8-amino-3,4-dihydro-2H-quinolin-1-yl)-(furan-2-yl)methanone (PubChem CID 82084861) has the molecular formula C14H14N2O2 and a molecular weight of 242.28 g/mol. Its IUPAC name is (8-amino-3,4-dihydro-2H-quinolin-1-yl)-(furan-2-yl)methanone.

Molecular Properties

Compound Name(8-amino-3,4-dihydro-2H-quinolin-1-yl)-(furan-2-yl)methanone
PubChem CID82084861
Molecular FormulaC14H14N2O2
Molecular Weight242.28 g/mol
Exact Mass242.11
IUPAC Name(8-amino-3,4-dihydro-2H-quinolin-1-yl)-(furan-2-yl)methanone
SMILESNc1cccc2c1N(C(=O)c1ccco1)CCC2
InChIInChI=1S/C14H14N2O2/c15-11-6-1-4-10-5-2-8-16(13(10)11)14(17)12-7-3-9-18-12/h1,3-4,6-7,9H,2,5,8,15H2
InChIKeyWRSNCMPQLHLLLO-UHFFFAOYSA-N
XLogP2.45
TPSA59.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (8-amino-3,4-dihydro-2H-quinolin-1-yl)-(furan-2-yl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(furan-2-carbonyl)pyrrolidin-2-one
CID 14424878
(8-amino-2,3-dihydro-1,4-benzoxazin-4-yl)-(furan-2-yl)methanone
CID 82294082
ethyl 1-(furan-2-carbonyl)-3,4-dihydro-2H-quinoline-6-carboxylate
CID 71919929
(7-amino-2,3-dihydroindol-1-yl)-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)methanone
CID 114455584
(7-amino-2,3-dihydroindol-1-yl)-pyrrolidin-1-ylmethanone
CID 114455948
furan-2-yl-(6-nitro-3,4-dihydro-2H-quinolin-1-yl)methanone
CID 164578193
(7-amino-2,3-dihydroindol-1-yl)-(2-fluorophenyl)methanone
CID 114455598
(7-amino-2,3-dihydroindol-1-yl)-(3-hydroxyphenyl)methanone
CID 114455702
3-(furan-2-yl)-1-(8-hydroxy-3,4-dihydro-2H-quinolin-1-yl)prop-2-en-1-one
CID 76987242
(3-aminofuran-2-yl)-(3,4-dihydro-2H-quinolin-1-yl)methanone
CID 139690672
(7-amino-2,3-dihydroindol-1-yl)-(2,4,6-trifluorophenyl)methanone
CID 114455780
azepan-1-yl(furan-2-yl)methanone
CID 5200992

Frequently Asked Questions

What is the IUPAC name of (8-amino-3,4-dihydro-2H-quinolin-1-yl)-(furan-2-yl)methanone?
The IUPAC name of (8-amino-3,4-dihydro-2H-quinolin-1-yl)-(furan-2-yl)methanone (CID 82084861) is (8-amino-3,4-dihydro-2H-quinolin-1-yl)-(furan-2-yl)methanone.
What is the SMILES notation for (8-amino-3,4-dihydro-2H-quinolin-1-yl)-(furan-2-yl)methanone?
The canonical SMILES for (8-amino-3,4-dihydro-2H-quinolin-1-yl)-(furan-2-yl)methanone is Nc1cccc2c1N(C(=O)c1ccco1)CCC2.
What is the InChIKey of (8-amino-3,4-dihydro-2H-quinolin-1-yl)-(furan-2-yl)methanone?
The InChIKey is WRSNCMPQLHLLLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2/c15-11-6-1-4-10-5-2-8-16(13(10)11)14(17)12-7-3-9-18-12/h1,3-4,6-7,9H,2,5,8,15H2.
What are the key properties of (8-amino-3,4-dihydro-2H-quinolin-1-yl)-(furan-2-yl)methanone?
(8-amino-3,4-dihydro-2H-quinolin-1-yl)-(furan-2-yl)methanone has a molecular weight of 242.28 g/mol, XLogP of 2.45, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (8-amino-3,4-dihydro-2H-quinolin-1-yl)-(furan-2-yl)methanone is sourced from PubChem (CID 82084861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).