(2R)-2-[4-(2-methylpropyl)phenyl]propanamide

C13H19NO — CID 715794

IUPAC(2R)-2-[4-(2-methylpropyl)phenyl]propanamide
SMILESCC(C)Cc1ccc([C@@H](C)C(N)=O)cc1
InChIInChI=1S/C13H19NO/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15/h4-7,9-10H,8H2,1-3H3,(H2,14,15)/t10-/m1/s1
InChIKeyREUQKCDCQVNKLW-SNVBAGLBSA-N
MW205.30 g/mol
LogP2.47
Rot. Bonds4

About (2R)-2-[4-(2-methylpropyl)phenyl]propanamide

(2R)-2-[4-(2-methylpropyl)phenyl]propanamide (PubChem CID 715794) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is (2R)-2-[4-(2-methylpropyl)phenyl]propanamide.

Molecular Properties

Compound Name(2R)-2-[4-(2-methylpropyl)phenyl]propanamide
PubChem CID715794
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name(2R)-2-[4-(2-methylpropyl)phenyl]propanamide
SMILESCC(C)Cc1ccc([C@@H](C)C(N)=O)cc1
InChIInChI=1S/C13H19NO/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15/h4-7,9-10H,8H2,1-3H3,(H2,14,15)/t10-/m1/s1
InChIKeyREUQKCDCQVNKLW-SNVBAGLBSA-N
XLogP2.47
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-[4-(2-methylpropyl)phenyl]propanamide?
The IUPAC name of (2R)-2-[4-(2-methylpropyl)phenyl]propanamide (CID 715794) is (2R)-2-[4-(2-methylpropyl)phenyl]propanamide.
What is the SMILES notation for (2R)-2-[4-(2-methylpropyl)phenyl]propanamide?
The canonical SMILES for (2R)-2-[4-(2-methylpropyl)phenyl]propanamide is CC(C)Cc1ccc([C@@H](C)C(N)=O)cc1.
What is the InChIKey of (2R)-2-[4-(2-methylpropyl)phenyl]propanamide?
The InChIKey is REUQKCDCQVNKLW-SNVBAGLBSA-N. The full InChI is InChI=1S/C13H19NO/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15/h4-7,9-10H,8H2,1-3H3,(H2,14,15)/t10-/m1/s1.
What are the key properties of (2R)-2-[4-(2-methylpropyl)phenyl]propanamide?
(2R)-2-[4-(2-methylpropyl)phenyl]propanamide has a molecular weight of 205.30 g/mol, XLogP of 2.47, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[4-(2-methylpropyl)phenyl]propanamide is sourced from PubChem (CID 715794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).