N-(4-cyclopropylphenyl)heptanamide

C16H23NO — CID 155735657

IUPACN-(4-cyclopropylphenyl)heptanamide
SMILESCCCCCCC(=O)Nc1ccc(C2CC2)cc1
InChIInChI=1S/C16H23NO/c1-2-3-4-5-6-16(18)17-15-11-9-14(10-12-15)13-7-8-13/h9-13H,2-8H2,1H3,(H,17,18)
InChIKeyFQBYJEGWBAALPN-UHFFFAOYSA-N
MW245.37 g/mol
LogP4.47
Rot. Bonds7

About N-(4-cyclopropylphenyl)heptanamide

N-(4-cyclopropylphenyl)heptanamide (PubChem CID 155735657) has the molecular formula C16H23NO and a molecular weight of 245.37 g/mol. Its IUPAC name is N-(4-cyclopropylphenyl)heptanamide.

Molecular Properties

Compound NameN-(4-cyclopropylphenyl)heptanamide
PubChem CID155735657
Molecular FormulaC16H23NO
Molecular Weight245.37 g/mol
Exact Mass245.18
IUPAC NameN-(4-cyclopropylphenyl)heptanamide
SMILESCCCCCCC(=O)Nc1ccc(C2CC2)cc1
InChIInChI=1S/C16H23NO/c1-2-3-4-5-6-16(18)17-15-11-9-14(10-12-15)13-7-8-13/h9-13H,2-8H2,1H3,(H,17,18)
InChIKeyFQBYJEGWBAALPN-UHFFFAOYSA-N
XLogP4.47
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 54.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-[4-(icosanoylamino)phenyl]icosanamide
CID 101291044
N-[4-(4-ethylcyclohexyl)phenyl]butanamide
CID 134294175
N-(4-acetamidophenyl)hexanamide
CID 4953736
N-(4-chlorophenyl)tridecanamide
CID 4195215
N-phenylpentacosanamide
CID 19025260
N-phenylheptatetracontanamide
CID 150503307
N-[4-[4-(heptanoylamino)phenoxy]phenyl]heptanamide
CID 3351099
N-[4-[2-[4-(dodecanoylamino)phenyl]ethynyl]phenyl]dodecanamide
CID 102416980
N-(4-tert-butylphenyl)dodecanamide
CID 118504435
N-(4-heptylphenyl)heptanamide
CID 101077737
N-(4-hydroxyphenyl)-6-(2-octadecanoylhydrazinyl)-6-oxohexanamide
CID 139759322
N-[4-(4-hydroxyphenyl)phenyl]octanamide
CID 139889893

Frequently Asked Questions

What is the IUPAC name of N-(4-cyclopropylphenyl)heptanamide?
The IUPAC name of N-(4-cyclopropylphenyl)heptanamide (CID 155735657) is N-(4-cyclopropylphenyl)heptanamide.
What is the SMILES notation for N-(4-cyclopropylphenyl)heptanamide?
The canonical SMILES for N-(4-cyclopropylphenyl)heptanamide is CCCCCCC(=O)Nc1ccc(C2CC2)cc1.
What is the InChIKey of N-(4-cyclopropylphenyl)heptanamide?
The InChIKey is FQBYJEGWBAALPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO/c1-2-3-4-5-6-16(18)17-15-11-9-14(10-12-15)13-7-8-13/h9-13H,2-8H2,1H3,(H,17,18).
What are the key properties of N-(4-cyclopropylphenyl)heptanamide?
N-(4-cyclopropylphenyl)heptanamide has a molecular weight of 245.37 g/mol, XLogP of 4.47, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyclopropylphenyl)heptanamide is sourced from PubChem (CID 155735657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).