N-methyl-N-[(2-methyl-5-thiophen-2-ylphenyl)methyl]formamide

C14H15NOS — CID 138566649

IUPACN-methyl-N-[(2-methyl-5-thiophen-2-ylphenyl)methyl]formamide
SMILESCc1ccc(-c2cccs2)cc1CN(C)C=O
InChIInChI=1S/C14H15NOS/c1-11-5-6-12(14-4-3-7-17-14)8-13(11)9-15(2)10-16/h3-8,10H,9H2,1-2H3
InChIKeyOJWAGWZCXMZZNY-UHFFFAOYSA-N
MW245.35 g/mol
LogP3.31
Rot. Bonds4

About N-methyl-N-[(2-methyl-5-thiophen-2-ylphenyl)methyl]formamide

N-methyl-N-[(2-methyl-5-thiophen-2-ylphenyl)methyl]formamide (PubChem CID 138566649) has the molecular formula C14H15NOS and a molecular weight of 245.35 g/mol. Its IUPAC name is N-methyl-N-[(2-methyl-5-thiophen-2-ylphenyl)methyl]formamide.

Molecular Properties

Compound NameN-methyl-N-[(2-methyl-5-thiophen-2-ylphenyl)methyl]formamide
PubChem CID138566649
Molecular FormulaC14H15NOS
Molecular Weight245.35 g/mol
Exact Mass245.09
IUPAC NameN-methyl-N-[(2-methyl-5-thiophen-2-ylphenyl)methyl]formamide
SMILESCc1ccc(-c2cccs2)cc1CN(C)C=O
InChIInChI=1S/C14H15NOS/c1-11-5-6-12(14-4-3-7-17-14)8-13(11)9-15(2)10-16/h3-8,10H,9H2,1-2H3
InChIKeyOJWAGWZCXMZZNY-UHFFFAOYSA-N
XLogP3.31
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.35
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-methyl-N-[(2-methyl-5-thiophen-2-ylphenyl)methyl]formamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-methyl-5-thiophen-2-ylbenzoic acid
CID 65309680
2-[2-[(dimethylamino)methyl]-4-thiophen-2-ylphenoxy]acetic acid
CID 122562095
cyclopentane;N-[(2,5-dimethylphenyl)methyl]-N-methylformamide;ethane;methanol
CID 145338686
4-hydroxy-N-methyl-N-(2-methyl-5-thiophen-2-ylphenyl)benzenesulfonamide
CID 67282795
5-(2-ethyl-4-thiophen-2-ylphenyl)thiophene-2-carbaldehyde
CID 141257882
(2-methyl-5-thiophen-2-ylphenyl)hydrazine
CID 54385611
CID 91433916
CID 91433916
ethane;2-methyl-4-thiophen-2-ylaniline
CID 143928116
2-(4-thiophen-2-ylphenyl)acetaldehyde
CID 87498538
2-(carboxymethyl)-4-thiophen-2-ylbenzoic acid
CID 121004062
1-(2-fluoro-5-thiophen-2-ylphenyl)-N-methylmethanamine
CID 61104003
ethane;2-methyl-4-thiophen-2-ylaniline;molecular hydrogen
CID 143928123

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(2-methyl-5-thiophen-2-ylphenyl)methyl]formamide?
The IUPAC name of N-methyl-N-[(2-methyl-5-thiophen-2-ylphenyl)methyl]formamide (CID 138566649) is N-methyl-N-[(2-methyl-5-thiophen-2-ylphenyl)methyl]formamide.
What is the SMILES notation for N-methyl-N-[(2-methyl-5-thiophen-2-ylphenyl)methyl]formamide?
The canonical SMILES for N-methyl-N-[(2-methyl-5-thiophen-2-ylphenyl)methyl]formamide is Cc1ccc(-c2cccs2)cc1CN(C)C=O.
What is the InChIKey of N-methyl-N-[(2-methyl-5-thiophen-2-ylphenyl)methyl]formamide?
The InChIKey is OJWAGWZCXMZZNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NOS/c1-11-5-6-12(14-4-3-7-17-14)8-13(11)9-15(2)10-16/h3-8,10H,9H2,1-2H3.
What are the key properties of N-methyl-N-[(2-methyl-5-thiophen-2-ylphenyl)methyl]formamide?
N-methyl-N-[(2-methyl-5-thiophen-2-ylphenyl)methyl]formamide has a molecular weight of 245.35 g/mol, XLogP of 3.31, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(2-methyl-5-thiophen-2-ylphenyl)methyl]formamide is sourced from PubChem (CID 138566649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).