(3-amino-3,4-dihydro-2H-quinolin-1-yl)-(5-methylfuran-3-yl)methanone

C15H16N2O2 — CID 114821989

IUPAC(3-amino-3,4-dihydro-2H-quinolin-1-yl)-(5-methylfuran-3-yl)methanone
SMILESCc1cc(C(=O)N2CC(N)Cc3ccccc32)co1
InChIInChI=1S/C15H16N2O2/c1-10-6-12(9-19-10)15(18)17-8-13(16)7-11-4-2-3-5-14(11)17/h2-6,9,13H,7-8,16H2,1H3
InChIKeyBNPDCWOOKUNCOZ-UHFFFAOYSA-N
MW256.31 g/mol
LogP2.12
Rot. Bonds1

About (3-amino-3,4-dihydro-2H-quinolin-1-yl)-(5-methylfuran-3-yl)methanone

(3-amino-3,4-dihydro-2H-quinolin-1-yl)-(5-methylfuran-3-yl)methanone (PubChem CID 114821989) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is (3-amino-3,4-dihydro-2H-quinolin-1-yl)-(5-methylfuran-3-yl)methanone.

Molecular Properties

Compound Name(3-amino-3,4-dihydro-2H-quinolin-1-yl)-(5-methylfuran-3-yl)methanone
PubChem CID114821989
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC Name(3-amino-3,4-dihydro-2H-quinolin-1-yl)-(5-methylfuran-3-yl)methanone
SMILESCc1cc(C(=O)N2CC(N)Cc3ccccc32)co1
InChIInChI=1S/C15H16N2O2/c1-10-6-12(9-19-10)15(18)17-8-13(16)7-11-4-2-3-5-14(11)17/h2-6,9,13H,7-8,16H2,1H3
InChIKeyBNPDCWOOKUNCOZ-UHFFFAOYSA-N
XLogP2.12
TPSA59.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (3-amino-3,4-dihydro-2H-quinolin-1-yl)-(5-methylfuran-3-yl)methanone with MolForge

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Related Compounds

(3-amino-3,4-dihydro-2H-quinolin-1-yl)-(4-hydroxy-3-methylphenyl)methanone
CID 107672090
(3-amino-3,4-dihydro-2H-quinolin-1-yl)-(2-methyl-4-pyridinyl)methanone
CID 106753653
1-(5-methylfuran-3-carbonyl)-2,3-dihydroindole-2-carboxylic acid
CID 114818785
(3-amino-3,4-dihydro-2H-quinolin-1-yl)-(2-chloro-4-methylphenyl)methanone
CID 106862190
(3-amino-3,4-dihydro-2H-quinolin-1-yl)-(2-bromofuran-3-yl)methanone
CID 106855124
3-(3-amino-3,4-dihydro-2H-quinoline-1-carbonyl)-6-methyl-1H-pyridin-2-one
CID 104772854
2,3-dihydro-1H-inden-2-yl-(5-methylfuran-3-yl)methanone
CID 106893079
5-(3-methyl-3,4-dihydro-2H-quinoline-1-carbonyl)furan-3-carboxylic acid
CID 104607589
1-(3-amino-3,4-dihydro-2H-quinolin-1-yl)-2,2-difluoroethanone
CID 103514183
(3-amino-3,4-dihydro-2H-quinolin-1-yl)-[(2R)-oxolan-2-yl]methanone
CID 104856313
(3-amino-3,4-dihydro-2H-quinolin-1-yl)-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone
CID 167937529
1-(5-methylfuran-3-carbonyl)-2,3-dihydroquinolin-4-one
CID 114820791

Frequently Asked Questions

What is the IUPAC name of (3-amino-3,4-dihydro-2H-quinolin-1-yl)-(5-methylfuran-3-yl)methanone?
The IUPAC name of (3-amino-3,4-dihydro-2H-quinolin-1-yl)-(5-methylfuran-3-yl)methanone (CID 114821989) is (3-amino-3,4-dihydro-2H-quinolin-1-yl)-(5-methylfuran-3-yl)methanone.
What is the SMILES notation for (3-amino-3,4-dihydro-2H-quinolin-1-yl)-(5-methylfuran-3-yl)methanone?
The canonical SMILES for (3-amino-3,4-dihydro-2H-quinolin-1-yl)-(5-methylfuran-3-yl)methanone is Cc1cc(C(=O)N2CC(N)Cc3ccccc32)co1.
What is the InChIKey of (3-amino-3,4-dihydro-2H-quinolin-1-yl)-(5-methylfuran-3-yl)methanone?
The InChIKey is BNPDCWOOKUNCOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-10-6-12(9-19-10)15(18)17-8-13(16)7-11-4-2-3-5-14(11)17/h2-6,9,13H,7-8,16H2,1H3.
What are the key properties of (3-amino-3,4-dihydro-2H-quinolin-1-yl)-(5-methylfuran-3-yl)methanone?
(3-amino-3,4-dihydro-2H-quinolin-1-yl)-(5-methylfuran-3-yl)methanone has a molecular weight of 256.31 g/mol, XLogP of 2.12, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-amino-3,4-dihydro-2H-quinolin-1-yl)-(5-methylfuran-3-yl)methanone is sourced from PubChem (CID 114821989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).