2-amino-N-(4-propylphenyl)propanamide

C12H18N2O — CID 43378686

IUPAC2-amino-N-(4-propylphenyl)propanamide
SMILESCCCc1ccc(NC(=O)C(C)N)cc1
InChIInChI=1S/C12H18N2O/c1-3-4-10-5-7-11(8-6-10)14-12(15)9(2)13/h5-9H,3-4,13H2,1-2H3,(H,14,15)
InChIKeyKHSHCCJALLHOAM-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.92
Rot. Bonds4

About 2-amino-N-(4-propylphenyl)propanamide

2-amino-N-(4-propylphenyl)propanamide (PubChem CID 43378686) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is 2-amino-N-(4-propylphenyl)propanamide.

Molecular Properties

Compound Name2-amino-N-(4-propylphenyl)propanamide
PubChem CID43378686
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name2-amino-N-(4-propylphenyl)propanamide
SMILESCCCc1ccc(NC(=O)C(C)N)cc1
InChIInChI=1S/C12H18N2O/c1-3-4-10-5-7-11(8-6-10)14-12(15)9(2)13/h5-9H,3-4,13H2,1-2H3,(H,14,15)
InChIKeyKHSHCCJALLHOAM-UHFFFAOYSA-N
XLogP1.92
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-amino-N-(4-propylphenyl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-amino-3-methyl-N-(4-propylphenyl)butanamide
CID 43378687
2-methyl-N-(4-propylphenyl)propanamide
CID 58658667
(2S)-2-amino-N-[4-(hydroxymethyl)phenyl]propanamide
CID 103691721
2-amino-3-methyl-N-[1-oxo-1-(4-propylanilino)propan-2-yl]butanamide
CID 177180405
3-methyl-2-[(4-propylphenyl)carbamoyl]butanoic acid
CID 115186130
(2S)-2-amino-N-[4-[(dimethylamino)methyl]phenyl]propanamide
CID 61146186
(2S)-2-amino-N-[4-(hydroxymethyl)phenyl]propanamide;methanol;molecular hydrogen
CID 142530006
(2R)-2-amino-N-(4-butylphenyl)-3-methylbutanamide
CID 79011565
(2R)-2-amino-N-[4-(propanoylamino)phenyl]propanamide;hydrochloride
CID 119296177
2-amino-N-(4-propoxyphenyl)propanamide
CID 62327124
4-(2-aminopropanoylamino)-N-ethylbenzamide
CID 43712262
N-(4-acetamidophenyl)-2-aminopropanamide;hydrochloride
CID 119261426

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(4-propylphenyl)propanamide?
The IUPAC name of 2-amino-N-(4-propylphenyl)propanamide (CID 43378686) is 2-amino-N-(4-propylphenyl)propanamide.
What is the SMILES notation for 2-amino-N-(4-propylphenyl)propanamide?
The canonical SMILES for 2-amino-N-(4-propylphenyl)propanamide is CCCc1ccc(NC(=O)C(C)N)cc1.
What is the InChIKey of 2-amino-N-(4-propylphenyl)propanamide?
The InChIKey is KHSHCCJALLHOAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-3-4-10-5-7-11(8-6-10)14-12(15)9(2)13/h5-9H,3-4,13H2,1-2H3,(H,14,15).
What are the key properties of 2-amino-N-(4-propylphenyl)propanamide?
2-amino-N-(4-propylphenyl)propanamide has a molecular weight of 206.29 g/mol, XLogP of 1.92, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(4-propylphenyl)propanamide is sourced from PubChem (CID 43378686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).