2-(N-acetyl-3-methylanilino)-N-ethyl-N-(3-methylphenyl)acetamide

C20H24N2O2 — CID 113167645

IUPAC2-(N-acetyl-3-methylanilino)-N-ethyl-N-(3-methylphenyl)acetamide
SMILESCCN(C(=O)CN(C(C)=O)c1cccc(C)c1)c1cccc(C)c1
InChIInChI=1S/C20H24N2O2/c1-5-21(18-10-6-8-15(2)12-18)20(24)14-22(17(4)23)19-11-7-9-16(3)13-19/h6-13H,5,14H2,1-4H3
InChIKeyMICYQVXPXNGRCH-UHFFFAOYSA-N
MW324.42 g/mol
LogP3.71
Rot. Bonds5

About 2-(N-acetyl-3-methylanilino)-N-ethyl-N-(3-methylphenyl)acetamide

2-(N-acetyl-3-methylanilino)-N-ethyl-N-(3-methylphenyl)acetamide (PubChem CID 113167645) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is 2-(N-acetyl-3-methylanilino)-N-ethyl-N-(3-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(N-acetyl-3-methylanilino)-N-ethyl-N-(3-methylphenyl)acetamide
PubChem CID113167645
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC Name2-(N-acetyl-3-methylanilino)-N-ethyl-N-(3-methylphenyl)acetamide
SMILESCCN(C(=O)CN(C(C)=O)c1cccc(C)c1)c1cccc(C)c1
InChIInChI=1S/C20H24N2O2/c1-5-21(18-10-6-8-15(2)12-18)20(24)14-22(17(4)23)19-11-7-9-16(3)13-19/h6-13H,5,14H2,1-4H3
InChIKeyMICYQVXPXNGRCH-UHFFFAOYSA-N
XLogP3.71
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(N-acetyl-3,4-dichloroanilino)-N-ethyl-N-(3-methylphenyl)acetamide
CID 113179532
2-(N-acetyl-3-chloro-4-fluoroanilino)-N-ethyl-N-(3-methylphenyl)acetamide
CID 113172485
methyl 4-[acetyl-[2-(N-ethyl-3-methylanilino)-2-oxoethyl]amino]benzoate
CID 113176496
2-(N-acetyl-3-methylanilino)-N,N-dipropylacetamide
CID 113167538
2-(N-acetyl-5-chloro-2-methylanilino)-N-ethyl-N-(3-methylphenyl)acetamide
CID 113171988
2-[N-acetyl-4-(diethylamino)-2-methylanilino]-N-ethyl-N-(3-methylphenyl)acetamide
CID 113180492
2-[acetyl(cyclohexyl)amino]-N-ethyl-N-(3-methylphenyl)acetamide
CID 113159596
2-(N-acetyl-3-methylanilino)-N-butyl-N-methylacetamide
CID 113167534
3-amino-N-ethyl-N-(3-methylphenyl)propanamide
CID 22692119
ethyl 4-(N-ethyl-3-methylanilino)-4-oxobutanoate
CID 60737731
N-(2-bromoprop-2-enyl)-N-(3-methylphenyl)acetamide
CID 121009695
N-ethyl-N,2-bis(3-methylphenyl)acetamide
CID 113099036

Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-3-methylanilino)-N-ethyl-N-(3-methylphenyl)acetamide?
The IUPAC name of 2-(N-acetyl-3-methylanilino)-N-ethyl-N-(3-methylphenyl)acetamide (CID 113167645) is 2-(N-acetyl-3-methylanilino)-N-ethyl-N-(3-methylphenyl)acetamide.
What is the SMILES notation for 2-(N-acetyl-3-methylanilino)-N-ethyl-N-(3-methylphenyl)acetamide?
The canonical SMILES for 2-(N-acetyl-3-methylanilino)-N-ethyl-N-(3-methylphenyl)acetamide is CCN(C(=O)CN(C(C)=O)c1cccc(C)c1)c1cccc(C)c1.
What is the InChIKey of 2-(N-acetyl-3-methylanilino)-N-ethyl-N-(3-methylphenyl)acetamide?
The InChIKey is MICYQVXPXNGRCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2/c1-5-21(18-10-6-8-15(2)12-18)20(24)14-22(17(4)23)19-11-7-9-16(3)13-19/h6-13H,5,14H2,1-4H3.
What are the key properties of 2-(N-acetyl-3-methylanilino)-N-ethyl-N-(3-methylphenyl)acetamide?
2-(N-acetyl-3-methylanilino)-N-ethyl-N-(3-methylphenyl)acetamide has a molecular weight of 324.42 g/mol, XLogP of 3.71, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-acetyl-3-methylanilino)-N-ethyl-N-(3-methylphenyl)acetamide is sourced from PubChem (CID 113167645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).