N-[2-(5-methylfuran-2-yl)phenyl]formamide

C12H11NO2 — CID 168653920

IUPACN-[2-(5-methylfuran-2-yl)phenyl]formamide
SMILESCc1ccc(-c2ccccc2NC=O)o1
InChIInChI=1S/C12H11NO2/c1-9-6-7-12(15-9)10-4-2-3-5-11(10)13-8-14/h2-8H,1H3,(H,13,14)
InChIKeySMOXJCAATKHSAE-UHFFFAOYSA-N
MW201.22 g/mol
LogP2.82
Rot. Bonds3

About N-[2-(5-methylfuran-2-yl)phenyl]formamide

N-[2-(5-methylfuran-2-yl)phenyl]formamide (PubChem CID 168653920) has the molecular formula C12H11NO2 and a molecular weight of 201.22 g/mol. Its IUPAC name is N-[2-(5-methylfuran-2-yl)phenyl]formamide.

Molecular Properties

Compound NameN-[2-(5-methylfuran-2-yl)phenyl]formamide
PubChem CID168653920
Molecular FormulaC12H11NO2
Molecular Weight201.22 g/mol
Exact Mass201.08
IUPAC NameN-[2-(5-methylfuran-2-yl)phenyl]formamide
SMILESCc1ccc(-c2ccccc2NC=O)o1
InChIInChI=1S/C12H11NO2/c1-9-6-7-12(15-9)10-4-2-3-5-11(10)13-8-14/h2-8H,1H3,(H,13,14)
InChIKeySMOXJCAATKHSAE-UHFFFAOYSA-N
XLogP2.82
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.22
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[2-(5-methylfuran-2-yl)phenyl]formamide?
The IUPAC name of N-[2-(5-methylfuran-2-yl)phenyl]formamide (CID 168653920) is N-[2-(5-methylfuran-2-yl)phenyl]formamide.
What is the SMILES notation for N-[2-(5-methylfuran-2-yl)phenyl]formamide?
The canonical SMILES for N-[2-(5-methylfuran-2-yl)phenyl]formamide is Cc1ccc(-c2ccccc2NC=O)o1.
What is the InChIKey of N-[2-(5-methylfuran-2-yl)phenyl]formamide?
The InChIKey is SMOXJCAATKHSAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11NO2/c1-9-6-7-12(15-9)10-4-2-3-5-11(10)13-8-14/h2-8H,1H3,(H,13,14).
What are the key properties of N-[2-(5-methylfuran-2-yl)phenyl]formamide?
N-[2-(5-methylfuran-2-yl)phenyl]formamide has a molecular weight of 201.22 g/mol, XLogP of 2.82, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5-methylfuran-2-yl)phenyl]formamide is sourced from PubChem (CID 168653920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).