N-methyl-N-(1-phenylpropan-2-yl)acetamide

C12H17NO — CID 526655

IUPACN-methyl-N-(1-phenylpropan-2-yl)acetamide
SMILESCC(=O)N(C)C(C)Cc1ccccc1
InChIInChI=1S/C12H17NO/c1-10(13(3)11(2)14)9-12-7-5-4-6-8-12/h4-8,10H,9H2,1-3H3
InChIKeyXCLNTWGFRQKLDT-UHFFFAOYSA-N
MW191.27 g/mol
LogP2.10
Rot. Bonds3

About N-methyl-N-(1-phenylpropan-2-yl)acetamide

N-methyl-N-(1-phenylpropan-2-yl)acetamide (PubChem CID 526655) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is N-methyl-N-(1-phenylpropan-2-yl)acetamide.

Molecular Properties

Compound NameN-methyl-N-(1-phenylpropan-2-yl)acetamide
PubChem CID526655
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC NameN-methyl-N-(1-phenylpropan-2-yl)acetamide
SMILESCC(=O)N(C)C(C)Cc1ccccc1
InChIInChI=1S/C12H17NO/c1-10(13(3)11(2)14)9-12-7-5-4-6-8-12/h4-8,10H,9H2,1-3H3
InChIKeyXCLNTWGFRQKLDT-UHFFFAOYSA-N
XLogP2.10
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(1-phenylpropan-2-yl)acetamide?
The IUPAC name of N-methyl-N-(1-phenylpropan-2-yl)acetamide (CID 526655) is N-methyl-N-(1-phenylpropan-2-yl)acetamide.
What is the SMILES notation for N-methyl-N-(1-phenylpropan-2-yl)acetamide?
The canonical SMILES for N-methyl-N-(1-phenylpropan-2-yl)acetamide is CC(=O)N(C)C(C)Cc1ccccc1.
What is the InChIKey of N-methyl-N-(1-phenylpropan-2-yl)acetamide?
The InChIKey is XCLNTWGFRQKLDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO/c1-10(13(3)11(2)14)9-12-7-5-4-6-8-12/h4-8,10H,9H2,1-3H3.
What are the key properties of N-methyl-N-(1-phenylpropan-2-yl)acetamide?
N-methyl-N-(1-phenylpropan-2-yl)acetamide has a molecular weight of 191.27 g/mol, XLogP of 2.10, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1-phenylpropan-2-yl)acetamide is sourced from PubChem (CID 526655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).