N-(1-phenylpropylideneamino)pentanamide

C14H20N2O — CID 4996868

IUPACN-(1-phenylpropylideneamino)pentanamide
SMILESCCCCC(=O)NN=C(CC)c1ccccc1
InChIInChI=1S/C14H20N2O/c1-3-5-11-14(17)16-15-13(4-2)12-9-7-6-8-10-12/h6-10H,3-5,11H2,1-2H3,(H,16,17)
InChIKeyKFPZFZGUHZEYCJ-UHFFFAOYSA-N
MW232.33 g/mol
LogP3.11
Rot. Bonds6

About N-(1-phenylpropylideneamino)pentanamide

N-(1-phenylpropylideneamino)pentanamide (PubChem CID 4996868) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is N-(1-phenylpropylideneamino)pentanamide.

Molecular Properties

Compound NameN-(1-phenylpropylideneamino)pentanamide
PubChem CID4996868
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC NameN-(1-phenylpropylideneamino)pentanamide
SMILESCCCCC(=O)NN=C(CC)c1ccccc1
InChIInChI=1S/C14H20N2O/c1-3-5-11-14(17)16-15-13(4-2)12-9-7-6-8-10-12/h6-10H,3-5,11H2,1-2H3,(H,16,17)
InChIKeyKFPZFZGUHZEYCJ-UHFFFAOYSA-N
XLogP3.11
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(1-phenylpentylideneamino)octanamide
CID 4676930
N-[(E)-1-(4-methoxyphenyl)propylideneamino]pentanamide
CID 6379049
N-[(Z)-1-(4-hydroxyphenyl)propylideneamino]hexanamide
CID 136716001
3-phenyl-N-(1-phenylpropylideneamino)propanamide
CID 5163167
3-phenyl-N-[(Z)-1-phenylpropylideneamino]propanamide
CID 6288373
4-(pentanoylamino)-N-(1-phenylpropylideneamino)benzamide
CID 4926136
N-[(E)-1-(4-hydroxyphenyl)propylideneamino]dodecanamide
CID 135704395
N-[(E)-1-(4-methylphenyl)propylideneamino]decanamide
CID 6262832
N-[(E)-1-(4-chlorophenyl)propylideneamino]hexanamide
CID 6029977
N-[1-(2-hydroxyphenyl)propylideneamino]pentanamide
CID 4060923
N,N'-bis[(E)-1-(4-hydroxyphenyl)propylideneamino]hexanediamide
CID 135721513
2-phenyl-N-(1-phenylpropylideneamino)acetamide
CID 689855

Frequently Asked Questions

What is the IUPAC name of N-(1-phenylpropylideneamino)pentanamide?
The IUPAC name of N-(1-phenylpropylideneamino)pentanamide (CID 4996868) is N-(1-phenylpropylideneamino)pentanamide.
What is the SMILES notation for N-(1-phenylpropylideneamino)pentanamide?
The canonical SMILES for N-(1-phenylpropylideneamino)pentanamide is CCCCC(=O)NN=C(CC)c1ccccc1.
What is the InChIKey of N-(1-phenylpropylideneamino)pentanamide?
The InChIKey is KFPZFZGUHZEYCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-3-5-11-14(17)16-15-13(4-2)12-9-7-6-8-10-12/h6-10H,3-5,11H2,1-2H3,(H,16,17).
What are the key properties of N-(1-phenylpropylideneamino)pentanamide?
N-(1-phenylpropylideneamino)pentanamide has a molecular weight of 232.33 g/mol, XLogP of 3.11, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-phenylpropylideneamino)pentanamide is sourced from PubChem (CID 4996868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).