4-methyl-N-(1-phenylethyl)furan-2-carboxamide

C14H15NO2 — CID 110850967

IUPAC4-methyl-N-(1-phenylethyl)furan-2-carboxamide
SMILESCc1coc(C(=O)NC(C)c2ccccc2)c1
InChIInChI=1S/C14H15NO2/c1-10-8-13(17-9-10)14(16)15-11(2)12-6-4-3-5-7-12/h3-9,11H,1-2H3,(H,15,16)
InChIKeyHJCARYCOJFHLCN-UHFFFAOYSA-N
MW229.28 g/mol
LogP3.08
Rot. Bonds3

About 4-methyl-N-(1-phenylethyl)furan-2-carboxamide

4-methyl-N-(1-phenylethyl)furan-2-carboxamide (PubChem CID 110850967) has the molecular formula C14H15NO2 and a molecular weight of 229.28 g/mol. Its IUPAC name is 4-methyl-N-(1-phenylethyl)furan-2-carboxamide.

Molecular Properties

Compound Name4-methyl-N-(1-phenylethyl)furan-2-carboxamide
PubChem CID110850967
Molecular FormulaC14H15NO2
Molecular Weight229.28 g/mol
Exact Mass229.11
IUPAC Name4-methyl-N-(1-phenylethyl)furan-2-carboxamide
SMILESCc1coc(C(=O)NC(C)c2ccccc2)c1
InChIInChI=1S/C14H15NO2/c1-10-8-13(17-9-10)14(16)15-11(2)12-6-4-3-5-7-12/h3-9,11H,1-2H3,(H,15,16)
InChIKeyHJCARYCOJFHLCN-UHFFFAOYSA-N
XLogP3.08
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-methyl-N-[(1S)-1-phenylethyl]furan-2-carboxamide
CID 844051
N-[(1R)-1-phenylethyl]-1,3-oxazole-5-carboxamide
CID 96586898
4-methyl-N-[(1S)-1-phenylethyl]benzamide
CID 730323
4-oxo-6-[[(1R)-1-phenylethyl]carbamoyl]pyran-2-carboxylic acid
CID 59356740
5-amino-N-(1-phenylethyl)furan-2-carboxamide
CID 82344125
N-(1-aminopropan-2-yl)-4-methylfuran-2-carboxamide
CID 83617743
2-methyl-N-[(1R)-1-phenylethyl]benzamide
CID 681346
N-[(1R)-1-phenylethyl]pyrimidine-2-carboxamide
CID 91294472
5-[(4-fluorophenyl)methoxy]-4-oxo-N-[(1S)-1-phenylethyl]pyran-2-carboxamide
CID 42227199
2-fluoro-4-methyl-N-(1-phenylethyl)benzamide
CID 79770350
2-ethyl-5-(1-phenylethylcarbamoyl)furan-3-carboxylic acid
CID 120820547
5-[(3-methylphenoxy)methyl]-N-(1-phenylethyl)furan-2-carboxamide
CID 19465616

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(1-phenylethyl)furan-2-carboxamide?
The IUPAC name of 4-methyl-N-(1-phenylethyl)furan-2-carboxamide (CID 110850967) is 4-methyl-N-(1-phenylethyl)furan-2-carboxamide.
What is the SMILES notation for 4-methyl-N-(1-phenylethyl)furan-2-carboxamide?
The canonical SMILES for 4-methyl-N-(1-phenylethyl)furan-2-carboxamide is Cc1coc(C(=O)NC(C)c2ccccc2)c1.
What is the InChIKey of 4-methyl-N-(1-phenylethyl)furan-2-carboxamide?
The InChIKey is HJCARYCOJFHLCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO2/c1-10-8-13(17-9-10)14(16)15-11(2)12-6-4-3-5-7-12/h3-9,11H,1-2H3,(H,15,16).
What are the key properties of 4-methyl-N-(1-phenylethyl)furan-2-carboxamide?
4-methyl-N-(1-phenylethyl)furan-2-carboxamide has a molecular weight of 229.28 g/mol, XLogP of 3.08, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(1-phenylethyl)furan-2-carboxamide is sourced from PubChem (CID 110850967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).