N-[3-(2-methylphenyl)cyclobutyl]furo[3,2-c]pyridine-4-carboxamide

C19H18N2O2 — CID 136583969

IUPACN-[3-(2-methylphenyl)cyclobutyl]furo[3,2-c]pyridine-4-carboxamide
SMILESCc1ccccc1C1CC(NC(=O)c2nccc3occc23)C1
InChIInChI=1S/C19H18N2O2/c1-12-4-2-3-5-15(12)13-10-14(11-13)21-19(22)18-16-7-9-23-17(16)6-8-20-18/h2-9,13-14H,10-11H2,1H3,(H,21,22)
InChIKeyBUWDZAURLPTVBQ-UHFFFAOYSA-N
MW306.37 g/mol
LogP3.81
Rot. Bonds3

About N-[3-(2-methylphenyl)cyclobutyl]furo[3,2-c]pyridine-4-carboxamide

N-[3-(2-methylphenyl)cyclobutyl]furo[3,2-c]pyridine-4-carboxamide (PubChem CID 136583969) has the molecular formula C19H18N2O2 and a molecular weight of 306.37 g/mol. Its IUPAC name is N-[3-(2-methylphenyl)cyclobutyl]furo[3,2-c]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[3-(2-methylphenyl)cyclobutyl]furo[3,2-c]pyridine-4-carboxamide
PubChem CID136583969
Molecular FormulaC19H18N2O2
Molecular Weight306.37 g/mol
Exact Mass306.14
IUPAC NameN-[3-(2-methylphenyl)cyclobutyl]furo[3,2-c]pyridine-4-carboxamide
SMILESCc1ccccc1C1CC(NC(=O)c2nccc3occc23)C1
InChIInChI=1S/C19H18N2O2/c1-12-4-2-3-5-15(12)13-10-14(11-13)21-19(22)18-16-7-9-23-17(16)6-8-20-18/h2-9,13-14H,10-11H2,1H3,(H,21,22)
InChIKeyBUWDZAURLPTVBQ-UHFFFAOYSA-N
XLogP3.81
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[3-(2-methylphenyl)cyclobutyl]furo[3,2-c]pyridine-4-carboxamide?
The IUPAC name of N-[3-(2-methylphenyl)cyclobutyl]furo[3,2-c]pyridine-4-carboxamide (CID 136583969) is N-[3-(2-methylphenyl)cyclobutyl]furo[3,2-c]pyridine-4-carboxamide.
What is the SMILES notation for N-[3-(2-methylphenyl)cyclobutyl]furo[3,2-c]pyridine-4-carboxamide?
The canonical SMILES for N-[3-(2-methylphenyl)cyclobutyl]furo[3,2-c]pyridine-4-carboxamide is Cc1ccccc1C1CC(NC(=O)c2nccc3occc23)C1.
What is the InChIKey of N-[3-(2-methylphenyl)cyclobutyl]furo[3,2-c]pyridine-4-carboxamide?
The InChIKey is BUWDZAURLPTVBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O2/c1-12-4-2-3-5-15(12)13-10-14(11-13)21-19(22)18-16-7-9-23-17(16)6-8-20-18/h2-9,13-14H,10-11H2,1H3,(H,21,22).
What are the key properties of N-[3-(2-methylphenyl)cyclobutyl]furo[3,2-c]pyridine-4-carboxamide?
N-[3-(2-methylphenyl)cyclobutyl]furo[3,2-c]pyridine-4-carboxamide has a molecular weight of 306.37 g/mol, XLogP of 3.81, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-methylphenyl)cyclobutyl]furo[3,2-c]pyridine-4-carboxamide is sourced from PubChem (CID 136583969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).