N-(4-cyanophenyl)pentanamide

C12H14N2O — CID 2162994

IUPACN-(4-cyanophenyl)pentanamide
SMILESCCCCC(=O)Nc1ccc(C#N)cc1
InChIInChI=1S/C12H14N2O/c1-2-3-4-12(15)14-11-7-5-10(9-13)6-8-11/h5-8H,2-4H2,1H3,(H,14,15)
InChIKeyZRGDTKXJUWJTSJ-UHFFFAOYSA-N
MW202.26 g/mol
LogP2.69
Rot. Bonds4

About N-(4-cyanophenyl)pentanamide

N-(4-cyanophenyl)pentanamide (PubChem CID 2162994) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is N-(4-cyanophenyl)pentanamide.

Molecular Properties

Compound NameN-(4-cyanophenyl)pentanamide
PubChem CID2162994
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC NameN-(4-cyanophenyl)pentanamide
SMILESCCCCC(=O)Nc1ccc(C#N)cc1
InChIInChI=1S/C12H14N2O/c1-2-3-4-12(15)14-11-7-5-10(9-13)6-8-11/h5-8H,2-4H2,1H3,(H,14,15)
InChIKeyZRGDTKXJUWJTSJ-UHFFFAOYSA-N
XLogP2.69
TPSA52.89 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,N'-bis(4-cyanophenyl)pentanediamide
CID 730657
N-[(4-cyanophenyl)carbamothioyl]octanamide
CID 4958873
N-(4-cyanophenyl)-3-(2-propoxyethoxy)propanamide
CID 63685828
2-butylsulfinyl-N-(4-cyanophenyl)acetamide
CID 64692326
N,N'-bis(4-cyanophenyl)propanediamide
CID 108956949
N-[4-[2-[4-(dodecanoylamino)phenyl]ethynyl]phenyl]dodecanamide
CID 102416980
N-(4-cyanophenyl)-3-[methylsulfonyl(pentyl)amino]propanamide
CID 113141371
N-(3,4-dicyanophenyl)pentanamide
CID 113240271
4-butan-2-yloxy-N-(4-cyanophenyl)butanamide
CID 54943716
N-(4-methylphenyl)pentanamide
CID 3662375
N-[4-(methylamino)phenyl]pentanamide
CID 71040406
methyl 4-(4-cyanoanilino)-4-oxobutanoate
CID 721957

Frequently Asked Questions

What is the IUPAC name of N-(4-cyanophenyl)pentanamide?
The IUPAC name of N-(4-cyanophenyl)pentanamide (CID 2162994) is N-(4-cyanophenyl)pentanamide.
What is the SMILES notation for N-(4-cyanophenyl)pentanamide?
The canonical SMILES for N-(4-cyanophenyl)pentanamide is CCCCC(=O)Nc1ccc(C#N)cc1.
What is the InChIKey of N-(4-cyanophenyl)pentanamide?
The InChIKey is ZRGDTKXJUWJTSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-2-3-4-12(15)14-11-7-5-10(9-13)6-8-11/h5-8H,2-4H2,1H3,(H,14,15).
What are the key properties of N-(4-cyanophenyl)pentanamide?
N-(4-cyanophenyl)pentanamide has a molecular weight of 202.26 g/mol, XLogP of 2.69, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyanophenyl)pentanamide is sourced from PubChem (CID 2162994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).