2-methyl-N-(1,2,3,4-tetrahydroisoquinolin-8-yl)furan-3-carboxamide

C15H16N2O2 — CID 114490943

IUPAC2-methyl-N-(1,2,3,4-tetrahydroisoquinolin-8-yl)furan-3-carboxamide
SMILESCc1occc1C(=O)Nc1cccc2c1CNCC2
InChIInChI=1S/C15H16N2O2/c1-10-12(6-8-19-10)15(18)17-14-4-2-3-11-5-7-16-9-13(11)14/h2-4,6,8,16H,5,7,9H2,1H3,(H,17,18)
InChIKeyVPECRYQZBBHEML-UHFFFAOYSA-N
MW256.31 g/mol
LogP2.49
Rot. Bonds2

About 2-methyl-N-(1,2,3,4-tetrahydroisoquinolin-8-yl)furan-3-carboxamide

2-methyl-N-(1,2,3,4-tetrahydroisoquinolin-8-yl)furan-3-carboxamide (PubChem CID 114490943) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is 2-methyl-N-(1,2,3,4-tetrahydroisoquinolin-8-yl)furan-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-(1,2,3,4-tetrahydroisoquinolin-8-yl)furan-3-carboxamide
PubChem CID114490943
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC Name2-methyl-N-(1,2,3,4-tetrahydroisoquinolin-8-yl)furan-3-carboxamide
SMILESCc1occc1C(=O)Nc1cccc2c1CNCC2
InChIInChI=1S/C15H16N2O2/c1-10-12(6-8-19-10)15(18)17-14-4-2-3-11-5-7-16-9-13(11)14/h2-4,6,8,16H,5,7,9H2,1H3,(H,17,18)
InChIKeyVPECRYQZBBHEML-UHFFFAOYSA-N
XLogP2.49
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-(1,2,3,4-tetrahydroisoquinolin-5-yl)furan-3-carboxamide
CID 80554325
N-(1,2,3,4-tetrahydroisoquinolin-8-yl)benzamide
CID 70303028
5-methyl-N-(1,2,3,4-tetrahydroisoquinolin-8-yl)pyrazine-2-carboxamide
CID 114490944
2-methyl-N-(1,2,3,4-tetrahydroisoquinolin-7-yl)furan-3-carboxamide;hydrochloride
CID 119581069
3-chloro-2-fluoro-N-(1,2,3,4-tetrahydroisoquinolin-8-yl)benzamide
CID 114491033
4-bromo-N-(1,2,3,4-tetrahydroisoquinolin-8-yl)benzamide
CID 114490823
N-(1,2,3,4-tetrahydroisoquinolin-8-yl)-1H-pyrrole-2-carboxamide
CID 114491001
4-bromo-2-fluoro-N-(1,2,3,4-tetrahydroisoquinolin-8-yl)benzamide
CID 114490903
N-(1,2,3,4-tetrahydroisoquinolin-8-yl)-1H-imidazole-5-carboxamide
CID 114491058
2-[(2-methylfuran-3-carbonyl)amino]benzoate
CID 2225644
3-methyl-N-(1,2,3,4-tetrahydroisoquinolin-8-yl)imidazole-4-carboxamide
CID 103510823
2,4-dimethyl-N-(1,2,3,4-tetrahydroisoquinolin-5-yl)benzamide
CID 43808455

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(1,2,3,4-tetrahydroisoquinolin-8-yl)furan-3-carboxamide?
The IUPAC name of 2-methyl-N-(1,2,3,4-tetrahydroisoquinolin-8-yl)furan-3-carboxamide (CID 114490943) is 2-methyl-N-(1,2,3,4-tetrahydroisoquinolin-8-yl)furan-3-carboxamide.
What is the SMILES notation for 2-methyl-N-(1,2,3,4-tetrahydroisoquinolin-8-yl)furan-3-carboxamide?
The canonical SMILES for 2-methyl-N-(1,2,3,4-tetrahydroisoquinolin-8-yl)furan-3-carboxamide is Cc1occc1C(=O)Nc1cccc2c1CNCC2.
What is the InChIKey of 2-methyl-N-(1,2,3,4-tetrahydroisoquinolin-8-yl)furan-3-carboxamide?
The InChIKey is VPECRYQZBBHEML-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-10-12(6-8-19-10)15(18)17-14-4-2-3-11-5-7-16-9-13(11)14/h2-4,6,8,16H,5,7,9H2,1H3,(H,17,18).
What are the key properties of 2-methyl-N-(1,2,3,4-tetrahydroisoquinolin-8-yl)furan-3-carboxamide?
2-methyl-N-(1,2,3,4-tetrahydroisoquinolin-8-yl)furan-3-carboxamide has a molecular weight of 256.31 g/mol, XLogP of 2.49, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(1,2,3,4-tetrahydroisoquinolin-8-yl)furan-3-carboxamide is sourced from PubChem (CID 114490943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).