formamide;N-phenylheptanamide

C14H22N2O2 — CID 143464966

IUPACformamide;N-phenylheptanamide
SMILESCCCCCCC(=O)Nc1ccccc1.NC=O
InChIInChI=1S/C13H19NO.CH3NO/c1-2-3-4-8-11-13(15)14-12-9-6-5-7-10-12;2-1-3/h5-7,9-10H,2-4,8,11H2,1H3,(H,14,15);1H,(H2,2,3)
InChIKeyARRVYVNHEDMVNV-UHFFFAOYSA-N
MW250.34 g/mol
LogP2.70
Rot. Bonds6

About formamide;N-phenylheptanamide

formamide;N-phenylheptanamide (PubChem CID 143464966) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is formamide;N-phenylheptanamide.

Molecular Properties

Compound Nameformamide;N-phenylheptanamide
PubChem CID143464966
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Nameformamide;N-phenylheptanamide
SMILESCCCCCCC(=O)Nc1ccccc1.NC=O
InChIInChI=1S/C13H19NO.CH3NO/c1-2-3-4-8-11-13(15)14-12-9-6-5-7-10-12;2-1-3/h5-7,9-10H,2-4,8,11H2,1H3,(H,14,15);1H,(H2,2,3)
InChIKeyARRVYVNHEDMVNV-UHFFFAOYSA-N
XLogP2.70
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-phenylpentacosanamide
CID 19025260
N-phenylheptatetracontanamide
CID 150503307
5-oxo-N-phenylheptadecanamide
CID 3308902
(Z)-N-phenyloctadec-9-enamide
CID 5354590
N-phenyldocos-13-enamide
CID 54224492
N-[4-(icosanoylamino)phenyl]icosanamide
CID 101291044
4-(dodecanoylamino)-N-phenylbenzamide
CID 5109500
N-[4-[(E)-2-phenylethenyl]phenyl]dodecanamide
CID 127035783
N-[4-(heptanoylamino)phenyl]benzamide
CID 54789055
1-(octanoylamino)-3-phenylurea
CID 5130887
4-amino-N-phenyldodecanamide
CID 154099763
11-anilino-11-oxoundecanoic acid
CID 150341840

Frequently Asked Questions

What is the IUPAC name of formamide;N-phenylheptanamide?
The IUPAC name of formamide;N-phenylheptanamide (CID 143464966) is formamide;N-phenylheptanamide.
What is the SMILES notation for formamide;N-phenylheptanamide?
The canonical SMILES for formamide;N-phenylheptanamide is CCCCCCC(=O)Nc1ccccc1.NC=O.
What is the InChIKey of formamide;N-phenylheptanamide?
The InChIKey is ARRVYVNHEDMVNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO.CH3NO/c1-2-3-4-8-11-13(15)14-12-9-6-5-7-10-12;2-1-3/h5-7,9-10H,2-4,8,11H2,1H3,(H,14,15);1H,(H2,2,3).
What are the key properties of formamide;N-phenylheptanamide?
formamide;N-phenylheptanamide has a molecular weight of 250.34 g/mol, XLogP of 2.70, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for formamide;N-phenylheptanamide is sourced from PubChem (CID 143464966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).