N-methyl-N-[(5-methylfuran-2-yl)methyl]-2-(2-methylphenyl)acetamide

C16H19NO2 — CID 78791590

IUPACN-methyl-N-[(5-methylfuran-2-yl)methyl]-2-(2-methylphenyl)acetamide
SMILESCc1ccc(CN(C)C(=O)Cc2ccccc2C)o1
InChIInChI=1S/C16H19NO2/c1-12-6-4-5-7-14(12)10-16(18)17(3)11-15-9-8-13(2)19-15/h4-9H,10-11H2,1-3H3
InChIKeyQMLDFORQKCNKQJ-UHFFFAOYSA-N
MW257.33 g/mol
LogP3.10
Rot. Bonds4

About N-methyl-N-[(5-methylfuran-2-yl)methyl]-2-(2-methylphenyl)acetamide

N-methyl-N-[(5-methylfuran-2-yl)methyl]-2-(2-methylphenyl)acetamide (PubChem CID 78791590) has the molecular formula C16H19NO2 and a molecular weight of 257.33 g/mol. Its IUPAC name is N-methyl-N-[(5-methylfuran-2-yl)methyl]-2-(2-methylphenyl)acetamide.

Molecular Properties

Compound NameN-methyl-N-[(5-methylfuran-2-yl)methyl]-2-(2-methylphenyl)acetamide
PubChem CID78791590
Molecular FormulaC16H19NO2
Molecular Weight257.33 g/mol
Exact Mass257.14
IUPAC NameN-methyl-N-[(5-methylfuran-2-yl)methyl]-2-(2-methylphenyl)acetamide
SMILESCc1ccc(CN(C)C(=O)Cc2ccccc2C)o1
InChIInChI=1S/C16H19NO2/c1-12-6-4-5-7-14(12)10-16(18)17(3)11-15-9-8-13(2)19-15/h4-9H,10-11H2,1-3H3
InChIKeyQMLDFORQKCNKQJ-UHFFFAOYSA-N
XLogP3.10
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-N-[(5-methylfuran-2-yl)methyl]-2-(2-nitrophenyl)acetamide
CID 4807483
2-(1H-indol-3-yl)-N-methyl-N-[(5-methylfuran-2-yl)methyl]acetamide
CID 7535659
2-methyl-5-[[methyl-[2-(2-methylphenyl)acetyl]amino]methyl]furan-3-carboxylic acid
CID 119222717
2-[4-(aminomethyl)phenyl]-N-methyl-N-[(5-methylfuran-2-yl)methyl]acetamide
CID 63590309
N-methyl-N-[(5-methylfuran-2-yl)methyl]-2-(2-methyl-N-propan-2-ylanilino)acetamide
CID 86953204
2-(2-benzylanilino)-N-methyl-N-[(5-methylfuran-2-yl)methyl]acetamide
CID 78822177
methyl-[(5-methylfuran-2-yl)methyl]carbamothioic S-acid
CID 115170193
N-[(4-ethoxyphenyl)methyl]-N-methyl-2-(2-methylphenyl)acetamide
CID 78788525
3-(2-aminophenoxy)-N-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide
CID 61093438
3-cyano-N-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide
CID 115173902
2-methyl-2-[[2-[methyl-[(5-methylfuran-2-yl)methyl]amino]-2-oxoethyl]amino]propanoic acid
CID 65263837
2-(2-fluorophenoxy)-N-methyl-N-[(5-methylfuran-2-yl)methyl]acetamide
CID 78784513

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(5-methylfuran-2-yl)methyl]-2-(2-methylphenyl)acetamide?
The IUPAC name of N-methyl-N-[(5-methylfuran-2-yl)methyl]-2-(2-methylphenyl)acetamide (CID 78791590) is N-methyl-N-[(5-methylfuran-2-yl)methyl]-2-(2-methylphenyl)acetamide.
What is the SMILES notation for N-methyl-N-[(5-methylfuran-2-yl)methyl]-2-(2-methylphenyl)acetamide?
The canonical SMILES for N-methyl-N-[(5-methylfuran-2-yl)methyl]-2-(2-methylphenyl)acetamide is Cc1ccc(CN(C)C(=O)Cc2ccccc2C)o1.
What is the InChIKey of N-methyl-N-[(5-methylfuran-2-yl)methyl]-2-(2-methylphenyl)acetamide?
The InChIKey is QMLDFORQKCNKQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO2/c1-12-6-4-5-7-14(12)10-16(18)17(3)11-15-9-8-13(2)19-15/h4-9H,10-11H2,1-3H3.
What are the key properties of N-methyl-N-[(5-methylfuran-2-yl)methyl]-2-(2-methylphenyl)acetamide?
N-methyl-N-[(5-methylfuran-2-yl)methyl]-2-(2-methylphenyl)acetamide has a molecular weight of 257.33 g/mol, XLogP of 3.10, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(5-methylfuran-2-yl)methyl]-2-(2-methylphenyl)acetamide is sourced from PubChem (CID 78791590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).