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

C10H14N2O — CID 839309

IUPACN-(4-amino-2-methylphenyl)propanamide
SMILESCCC(=O)Nc1ccc(N)cc1C
InChIInChI=1S/C10H14N2O/c1-3-10(13)12-9-5-4-8(11)6-7(9)2/h4-6H,3,11H2,1-2H3,(H,12,13)
InChIKeyXKIFOCOJJXDOAM-UHFFFAOYSA-N
MW178.23 g/mol
LogP1.93
Rot. Bonds2

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

N-(4-amino-2-methylphenyl)propanamide (PubChem CID 839309) has the molecular formula C10H14N2O and a molecular weight of 178.23 g/mol. Its IUPAC name is N-(4-amino-2-methylphenyl)propanamide.

Molecular Properties

Compound NameN-(4-amino-2-methylphenyl)propanamide
PubChem CID839309
Molecular FormulaC10H14N2O
Molecular Weight178.23 g/mol
Exact Mass178.11
IUPAC NameN-(4-amino-2-methylphenyl)propanamide
SMILESCCC(=O)Nc1ccc(N)cc1C
InChIInChI=1S/C10H14N2O/c1-3-10(13)12-9-5-4-8(11)6-7(9)2/h4-6H,3,11H2,1-2H3,(H,12,13)
InChIKeyXKIFOCOJJXDOAM-UHFFFAOYSA-N
XLogP1.93
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(4-amino-2-methylphenyl)-3-methylbutanamide
CID 960629
N-(4-amino-2-methylphenyl)-3-[methyl(propyl)amino]propanamide
CID 43270832
N-(2-methyl-4-sulfamoylphenyl)propanamide
CID 43133967
N-(4-amino-2-ethoxyphenyl)propanamide
CID 95910426
3-(4-amino-2-methylphenyl)-1-ethyl-1-methylurea
CID 79152927
2-[[2-(4-amino-2-methylanilino)-2-oxoethyl]-methylamino]-N-methylacetamide
CID 43374519
N-(4-amino-2-methylphenyl)-4-(dipropylamino)butanamide
CID 16779092
N-(4-amino-2-methylphenyl)-2-(4-methyl-2-oxo-1-pyridinyl)acetamide
CID 62962656
N-(4-amino-2-methylphenyl)-2-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]acetamide
CID 43588199
N-(4-amino-2-methylphenyl)-2-(3,4-dichlorophenyl)acetamide
CID 63045442
N-(4-amino-2-methylphenyl)-2-methylpropanamide
CID 960642
N-(4-amino-2-methylphenyl)-4-[ethyl(propan-2-yl)amino]butanamide
CID 43265362

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-2-methylphenyl)propanamide?
The IUPAC name of N-(4-amino-2-methylphenyl)propanamide (CID 839309) is N-(4-amino-2-methylphenyl)propanamide.
What is the SMILES notation for N-(4-amino-2-methylphenyl)propanamide?
The canonical SMILES for N-(4-amino-2-methylphenyl)propanamide is CCC(=O)Nc1ccc(N)cc1C.
What is the InChIKey of N-(4-amino-2-methylphenyl)propanamide?
The InChIKey is XKIFOCOJJXDOAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O/c1-3-10(13)12-9-5-4-8(11)6-7(9)2/h4-6H,3,11H2,1-2H3,(H,12,13).
What are the key properties of N-(4-amino-2-methylphenyl)propanamide?
N-(4-amino-2-methylphenyl)propanamide has a molecular weight of 178.23 g/mol, XLogP of 1.93, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-2-methylphenyl)propanamide is sourced from PubChem (CID 839309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).