N-(2-methylpropyl)-2-phenylacetamide

C12H17NO — CID 668859

IUPACN-(2-methylpropyl)-2-phenylacetamide
SMILESCC(C)CNC(=O)Cc1ccccc1
InChIInChI=1S/C12H17NO/c1-10(2)9-13-12(14)8-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3,(H,13,14)
InChIKeyCZMUPZDWASDNHR-UHFFFAOYSA-N
MW191.27 g/mol
LogP2.00
Rot. Bonds4

About N-(2-methylpropyl)-2-phenylacetamide

N-(2-methylpropyl)-2-phenylacetamide (PubChem CID 668859) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is N-(2-methylpropyl)-2-phenylacetamide.

Molecular Properties

Compound NameN-(2-methylpropyl)-2-phenylacetamide
PubChem CID668859
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC NameN-(2-methylpropyl)-2-phenylacetamide
SMILESCC(C)CNC(=O)Cc1ccccc1
InChIInChI=1S/C12H17NO/c1-10(2)9-13-12(14)8-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3,(H,13,14)
InChIKeyCZMUPZDWASDNHR-UHFFFAOYSA-N
XLogP2.00
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-2-phenylacetamide?
The IUPAC name of N-(2-methylpropyl)-2-phenylacetamide (CID 668859) is N-(2-methylpropyl)-2-phenylacetamide.
What is the SMILES notation for N-(2-methylpropyl)-2-phenylacetamide?
The canonical SMILES for N-(2-methylpropyl)-2-phenylacetamide is CC(C)CNC(=O)Cc1ccccc1.
What is the InChIKey of N-(2-methylpropyl)-2-phenylacetamide?
The InChIKey is CZMUPZDWASDNHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO/c1-10(2)9-13-12(14)8-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3,(H,13,14).
What are the key properties of N-(2-methylpropyl)-2-phenylacetamide?
N-(2-methylpropyl)-2-phenylacetamide has a molecular weight of 191.27 g/mol, XLogP of 2.00, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-2-phenylacetamide is sourced from PubChem (CID 668859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).