2-(methylamino)-N-(4-pentylphenyl)acetamide

C14H22N2O — CID 61249144

IUPAC2-(methylamino)-N-(4-pentylphenyl)acetamide
SMILESCCCCCc1ccc(NC(=O)CNC)cc1
InChIInChI=1S/C14H22N2O/c1-3-4-5-6-12-7-9-13(10-8-12)16-14(17)11-15-2/h7-10,15H,3-6,11H2,1-2H3,(H,16,17)
InChIKeyMPMOPTJHVUJSCG-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.58
Rot. Bonds7

About 2-(methylamino)-N-(4-pentylphenyl)acetamide

2-(methylamino)-N-(4-pentylphenyl)acetamide (PubChem CID 61249144) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 2-(methylamino)-N-(4-pentylphenyl)acetamide.

Molecular Properties

Compound Name2-(methylamino)-N-(4-pentylphenyl)acetamide
PubChem CID61249144
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name2-(methylamino)-N-(4-pentylphenyl)acetamide
SMILESCCCCCc1ccc(NC(=O)CNC)cc1
InChIInChI=1S/C14H22N2O/c1-3-4-5-6-12-7-9-13(10-8-12)16-14(17)11-15-2/h7-10,15H,3-6,11H2,1-2H3,(H,16,17)
InChIKeyMPMOPTJHVUJSCG-UHFFFAOYSA-N
XLogP2.58
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(4-heptylphenyl)heptanamide
CID 101077737
4-amino-N-(4-pentylphenyl)butanamide
CID 61248586
4-chloro-N-(4-heptylphenyl)-3-oxobutanamide
CID 86085625
6-amino-N-(4-pentylphenyl)hexanamide
CID 61248961
2-(butan-2-ylamino)-N-(4-butylphenyl)acetamide
CID 54917864
N-(4-pentylphenyl)-2-[(2-phenoxyacetyl)amino]acetamide
CID 26776941
N,N'-bis(4-butylphenyl)oxamide
CID 3438016
3-methyl-N-[2-oxo-2-(4-pentylanilino)ethyl]benzamide
CID 26776933
N-[2-(4-methoxyanilino)-2-oxoethyl]-4-pentylbenzamide
CID 4016608
N-[4-[[2-(methylamino)acetyl]amino]phenyl]-3-phenylpropanamide
CID 54820849
N'-(4-dodecylphenyl)oxamide
CID 118096540
N-(4-octylphenyl)undec-2-enamide
CID 167433429

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-(4-pentylphenyl)acetamide?
The IUPAC name of 2-(methylamino)-N-(4-pentylphenyl)acetamide (CID 61249144) is 2-(methylamino)-N-(4-pentylphenyl)acetamide.
What is the SMILES notation for 2-(methylamino)-N-(4-pentylphenyl)acetamide?
The canonical SMILES for 2-(methylamino)-N-(4-pentylphenyl)acetamide is CCCCCc1ccc(NC(=O)CNC)cc1.
What is the InChIKey of 2-(methylamino)-N-(4-pentylphenyl)acetamide?
The InChIKey is MPMOPTJHVUJSCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-3-4-5-6-12-7-9-13(10-8-12)16-14(17)11-15-2/h7-10,15H,3-6,11H2,1-2H3,(H,16,17).
What are the key properties of 2-(methylamino)-N-(4-pentylphenyl)acetamide?
2-(methylamino)-N-(4-pentylphenyl)acetamide has a molecular weight of 234.34 g/mol, XLogP of 2.58, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-(4-pentylphenyl)acetamide is sourced from PubChem (CID 61249144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).