N-(5-phenylthiophen-2-yl)formamide

C11H9NOS — CID 58761918

IUPACN-(5-phenylthiophen-2-yl)formamide
SMILESO=CNc1ccc(-c2ccccc2)s1
InChIInChI=1S/C11H9NOS/c13-8-12-11-7-6-10(14-11)9-4-2-1-3-5-9/h1-8H,(H,12,13)
InChIKeyDGDYDNMNSRLIDH-UHFFFAOYSA-N
MW203.27 g/mol
LogP2.98
Rot. Bonds3

About N-(5-phenylthiophen-2-yl)formamide

N-(5-phenylthiophen-2-yl)formamide (PubChem CID 58761918) has the molecular formula C11H9NOS and a molecular weight of 203.27 g/mol. Its IUPAC name is N-(5-phenylthiophen-2-yl)formamide.

Molecular Properties

Compound NameN-(5-phenylthiophen-2-yl)formamide
PubChem CID58761918
Molecular FormulaC11H9NOS
Molecular Weight203.27 g/mol
Exact Mass203.04
IUPAC NameN-(5-phenylthiophen-2-yl)formamide
SMILESO=CNc1ccc(-c2ccccc2)s1
InChIInChI=1S/C11H9NOS/c13-8-12-11-7-6-10(14-11)9-4-2-1-3-5-9/h1-8H,(H,12,13)
InChIKeyDGDYDNMNSRLIDH-UHFFFAOYSA-N
XLogP2.98
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.27
LogP ≤ 52.98
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-(5-phenylthiophen-2-yl)formamide?
The IUPAC name of N-(5-phenylthiophen-2-yl)formamide (CID 58761918) is N-(5-phenylthiophen-2-yl)formamide.
What is the SMILES notation for N-(5-phenylthiophen-2-yl)formamide?
The canonical SMILES for N-(5-phenylthiophen-2-yl)formamide is O=CNc1ccc(-c2ccccc2)s1.
What is the InChIKey of N-(5-phenylthiophen-2-yl)formamide?
The InChIKey is DGDYDNMNSRLIDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9NOS/c13-8-12-11-7-6-10(14-11)9-4-2-1-3-5-9/h1-8H,(H,12,13).
What are the key properties of N-(5-phenylthiophen-2-yl)formamide?
N-(5-phenylthiophen-2-yl)formamide has a molecular weight of 203.27 g/mol, XLogP of 2.98, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-phenylthiophen-2-yl)formamide is sourced from PubChem (CID 58761918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).