7-amino-N-phenylmethoxyheptanamide

C14H22N2O2 — CID 59535540

IUPAC7-amino-N-phenylmethoxyheptanamide
SMILESNCCCCCCC(=O)NOCc1ccccc1
InChIInChI=1S/C14H22N2O2/c15-11-7-2-1-6-10-14(17)16-18-12-13-8-4-3-5-9-13/h3-5,8-9H,1-2,6-7,10-12,15H2,(H,16,17)
InChIKeyUVPSVEWFOABFGF-UHFFFAOYSA-N
MW250.34 g/mol
LogP2.14
Rot. Bonds9

About 7-amino-N-phenylmethoxyheptanamide

7-amino-N-phenylmethoxyheptanamide (PubChem CID 59535540) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 7-amino-N-phenylmethoxyheptanamide.

Molecular Properties

Compound Name7-amino-N-phenylmethoxyheptanamide
PubChem CID59535540
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name7-amino-N-phenylmethoxyheptanamide
SMILESNCCCCCCC(=O)NOCc1ccccc1
InChIInChI=1S/C14H22N2O2/c15-11-7-2-1-6-10-14(17)16-18-12-13-8-4-3-5-9-13/h3-5,8-9H,1-2,6-7,10-12,15H2,(H,16,17)
InChIKeyUVPSVEWFOABFGF-UHFFFAOYSA-N
XLogP2.14
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

8-amino-N-phenylmethoxyoctanamide;ethane;ethene
CID 143768165
7-oxo-7-(phenylmethoxyamino)heptanoic acid
CID 57439168
[6-oxo-6-(phenylmethoxyamino)hexyl]azanium
CID 59535547
[7-oxo-7-(phenylmethoxyamino)heptyl]azanium
CID 59535539
N-phenylmethoxyhexanamide
CID 60717350
chloro-[5-oxo-5-(phenylmethoxyamino)pentyl]azanide
CID 59535535
3-(2-aminoethoxy)-N-phenylmethoxypropanamide
CID 130524558
8-amino-N-phenylmethoxydecanamide;hydrochloride
CID 174601541
chloro-[4-oxo-4-(phenylmethoxyamino)butyl]azanide
CID 59535491
N-(4-formylphenyl)-N'-phenylmethoxyoctanediamide
CID 23900156
benzyl 6-aminohexanoate;hydrochloride
CID 67401791
(2S)-2-amino-N-phenyl-N'-phenylmethoxyoctanediamide
CID 72946637

Frequently Asked Questions

What is the IUPAC name of 7-amino-N-phenylmethoxyheptanamide?
The IUPAC name of 7-amino-N-phenylmethoxyheptanamide (CID 59535540) is 7-amino-N-phenylmethoxyheptanamide.
What is the SMILES notation for 7-amino-N-phenylmethoxyheptanamide?
The canonical SMILES for 7-amino-N-phenylmethoxyheptanamide is NCCCCCCC(=O)NOCc1ccccc1.
What is the InChIKey of 7-amino-N-phenylmethoxyheptanamide?
The InChIKey is UVPSVEWFOABFGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c15-11-7-2-1-6-10-14(17)16-18-12-13-8-4-3-5-9-13/h3-5,8-9H,1-2,6-7,10-12,15H2,(H,16,17).
What are the key properties of 7-amino-N-phenylmethoxyheptanamide?
7-amino-N-phenylmethoxyheptanamide has a molecular weight of 250.34 g/mol, XLogP of 2.14, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-N-phenylmethoxyheptanamide is sourced from PubChem (CID 59535540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).