N-(4-formamido-2-methylphenyl)pentanamide

C13H18N2O2 — CID 168653385

IUPACN-(4-formamido-2-methylphenyl)pentanamide
SMILESCCCCC(=O)Nc1ccc(NC=O)cc1C
InChIInChI=1S/C13H18N2O2/c1-3-4-5-13(17)15-12-7-6-11(14-9-16)8-10(12)2/h6-9H,3-5H2,1-2H3,(H,14,16)(H,15,17)
InChIKeyMDTDSNMHTBQERT-UHFFFAOYSA-N
MW234.30 g/mol
LogP2.69
Rot. Bonds6

About N-(4-formamido-2-methylphenyl)pentanamide

N-(4-formamido-2-methylphenyl)pentanamide (PubChem CID 168653385) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is N-(4-formamido-2-methylphenyl)pentanamide.

Molecular Properties

Compound NameN-(4-formamido-2-methylphenyl)pentanamide
PubChem CID168653385
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC NameN-(4-formamido-2-methylphenyl)pentanamide
SMILESCCCCC(=O)Nc1ccc(NC=O)cc1C
InChIInChI=1S/C13H18N2O2/c1-3-4-5-13(17)15-12-7-6-11(14-9-16)8-10(12)2/h6-9H,3-5H2,1-2H3,(H,14,16)(H,15,17)
InChIKeyMDTDSNMHTBQERT-UHFFFAOYSA-N
XLogP2.69
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-(4-formamido-2-methylphenyl)pentanamide 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

N-[4-(4-aminobutanoylamino)-2-methylphenyl]pentanamide
CID 39193527
N-(4-formyl-2-methylphenyl)dodecanamide
CID 54174472
N-[4-[4-(heptanoylamino)-3-methylphenyl]-2-methylphenyl]heptanamide
CID 4180295
N-(4-fluoro-2-methylphenyl)hexanamide
CID 17069266
N-(4-bromo-2-methylphenyl)octanamide
CID 4582485
N-[4-[(2-cyanoacetyl)amino]-2-methylphenyl]butanamide
CID 168522119
4-(henicosanoylamino)-3-methylbenzoic acid
CID 12800016
N-[3-(4-aminobutanoylamino)-4-methylphenyl]pentanamide
CID 39193331
N-(3,4-dimethylphenyl)dodecanamide
CID 4067786
N-[3-methyl-4-(methylamino)phenyl]butanamide
CID 175204219
N-(4-methylphenyl)pentanamide
CID 3662375
N-(2,4-dimethylphenyl)-4-(hexanoylamino)benzamide
CID 3645447

Frequently Asked Questions

What is the IUPAC name of N-(4-formamido-2-methylphenyl)pentanamide?
The IUPAC name of N-(4-formamido-2-methylphenyl)pentanamide (CID 168653385) is N-(4-formamido-2-methylphenyl)pentanamide.
What is the SMILES notation for N-(4-formamido-2-methylphenyl)pentanamide?
The canonical SMILES for N-(4-formamido-2-methylphenyl)pentanamide is CCCCC(=O)Nc1ccc(NC=O)cc1C.
What is the InChIKey of N-(4-formamido-2-methylphenyl)pentanamide?
The InChIKey is MDTDSNMHTBQERT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2/c1-3-4-5-13(17)15-12-7-6-11(14-9-16)8-10(12)2/h6-9H,3-5H2,1-2H3,(H,14,16)(H,15,17).
What are the key properties of N-(4-formamido-2-methylphenyl)pentanamide?
N-(4-formamido-2-methylphenyl)pentanamide has a molecular weight of 234.30 g/mol, XLogP of 2.69, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-formamido-2-methylphenyl)pentanamide is sourced from PubChem (CID 168653385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).