2-(4-phenylanilino)-N-propylacetamide

C17H20N2O — CID 47117859

IUPAC2-(4-phenylanilino)-N-propylacetamide
SMILESCCCNC(=O)CNc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C17H20N2O/c1-2-12-18-17(20)13-19-16-10-8-15(9-11-16)14-6-4-3-5-7-14/h3-11,19H,2,12-13H2,1H3,(H,18,20)
InChIKeyMZAVLRHABALGFA-UHFFFAOYSA-N
MW268.36 g/mol
LogP3.29
Rot. Bonds6

About 2-(4-phenylanilino)-N-propylacetamide

2-(4-phenylanilino)-N-propylacetamide (PubChem CID 47117859) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is 2-(4-phenylanilino)-N-propylacetamide.

Molecular Properties

Compound Name2-(4-phenylanilino)-N-propylacetamide
PubChem CID47117859
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC Name2-(4-phenylanilino)-N-propylacetamide
SMILESCCCNC(=O)CNc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C17H20N2O/c1-2-12-18-17(20)13-19-16-10-8-15(9-11-16)14-6-4-3-5-7-14/h3-11,19H,2,12-13H2,1H3,(H,18,20)
InChIKeyMZAVLRHABALGFA-UHFFFAOYSA-N
XLogP3.29
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 53.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-anilino-N-[2-oxo-2-(propylamino)ethyl]acetamide;hydrochloride
CID 119689818
N-(cyanomethyl)-2-(4-phenylanilino)acetamide
CID 62254224
N-(2-methylpropyl)-2-(4-phenylanilino)acetamide
CID 60647076
N-propyl-2-(4-propylanilino)acetamide
CID 43216175
2-(naphthalen-2-ylamino)-N-propylacetamide
CID 43400801
bicyclo[2.2.0]hexa-1,3,5-triene;2-phenyl-N-propylacetamide
CID 175085430
N,N-diethyl-4-[[2-oxo-2-(propylamino)ethyl]amino]benzamide
CID 54833878
2-[[2-(4-phenylphenoxy)acetyl]amino]-N-propylacetamide
CID 9163146
2-anilino-N-(3-hydroxypropyl)acetamide
CID 60861419
2-(4-ethyl-3-methylanilino)-N-propylacetamide
CID 113346217
2-[3-(2-phenoxyethoxy)anilino]-N-propylacetamide
CID 54825848
2-(9H-fluoren-2-ylamino)-N-propylacetamide
CID 28574289

Frequently Asked Questions

What is the IUPAC name of 2-(4-phenylanilino)-N-propylacetamide?
The IUPAC name of 2-(4-phenylanilino)-N-propylacetamide (CID 47117859) is 2-(4-phenylanilino)-N-propylacetamide.
What is the SMILES notation for 2-(4-phenylanilino)-N-propylacetamide?
The canonical SMILES for 2-(4-phenylanilino)-N-propylacetamide is CCCNC(=O)CNc1ccc(-c2ccccc2)cc1.
What is the InChIKey of 2-(4-phenylanilino)-N-propylacetamide?
The InChIKey is MZAVLRHABALGFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-2-12-18-17(20)13-19-16-10-8-15(9-11-16)14-6-4-3-5-7-14/h3-11,19H,2,12-13H2,1H3,(H,18,20).
What are the key properties of 2-(4-phenylanilino)-N-propylacetamide?
2-(4-phenylanilino)-N-propylacetamide has a molecular weight of 268.36 g/mol, XLogP of 3.29, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-phenylanilino)-N-propylacetamide is sourced from PubChem (CID 47117859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).