N-(2-hydroxy-5-nitrophenyl)nonanamide

C15H22N2O4 — CID 13255814

IUPACN-(2-hydroxy-5-nitrophenyl)nonanamide
SMILESCCCCCCCCC(=O)Nc1cc([N+](=O)[O-])ccc1O
InChIInChI=1S/C15H22N2O4/c1-2-3-4-5-6-7-8-15(19)16-13-11-12(17(20)21)9-10-14(13)18/h9-11,18H,2-8H2,1H3,(H,16,19)
InChIKeyNXHOADQRRFRKSO-UHFFFAOYSA-N
MW294.35 g/mol
LogP3.99
Rot. Bonds9

About N-(2-hydroxy-5-nitrophenyl)nonanamide

N-(2-hydroxy-5-nitrophenyl)nonanamide (PubChem CID 13255814) has the molecular formula C15H22N2O4 and a molecular weight of 294.35 g/mol. Its IUPAC name is N-(2-hydroxy-5-nitrophenyl)nonanamide.

Molecular Properties

Compound NameN-(2-hydroxy-5-nitrophenyl)nonanamide
PubChem CID13255814
Molecular FormulaC15H22N2O4
Molecular Weight294.35 g/mol
Exact Mass294.16
IUPAC NameN-(2-hydroxy-5-nitrophenyl)nonanamide
SMILESCCCCCCCCC(=O)Nc1cc([N+](=O)[O-])ccc1O
InChIInChI=1S/C15H22N2O4/c1-2-3-4-5-6-7-8-15(19)16-13-11-12(17(20)21)9-10-14(13)18/h9-11,18H,2-8H2,1H3,(H,16,19)
InChIKeyNXHOADQRRFRKSO-UHFFFAOYSA-N
XLogP3.99
TPSA92.47 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 53.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(4-Hydroxy-3-nitrophenyl)acetamide
CID 3322389
2-Bromo-N-(2-hydroxy-5-nitrophenyl)acetamide
CID 4089912
N-(2-hydroxy-5-nitrophenyl)-3-nitrobenzamide
CID 3090473
Acetamide, N-(2-hydroxy-5-nitrophenyl)-
CID 3292867
5-(2-Hydroxy-5-nitroanilino)-3-methyl-5-oxopentanoic acid
CID 4129445
N-(5-amino-2-hydroxyphenyl)-2-phenylacetamide
CID 10263768
N-(4-Hydroxyphenyl)nonan-1-amide
CID 66875
1-(2-Hydroxy-5-nitro-phenyl)-3-phenyl-urea
CID 11818139
4-[(2-Hydroxy-5-nitrophenyl)carbamoyl]-2-propylbutanoic acid
CID 16194339
2-{2-[(2-Hydroxy-5-nitrophenyl)carbamoyl]ethyl}hexanoic acid
CID 16194340
5-[(2-Hydroxy-5-nitrophenyl)amino]-5-oxopentanoic acid
CID 3546109
N-(2-hydroxy-5-nitrophenyl)butanamide
CID 3599768

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-5-nitrophenyl)nonanamide?
The IUPAC name of N-(2-hydroxy-5-nitrophenyl)nonanamide (CID 13255814) is N-(2-hydroxy-5-nitrophenyl)nonanamide.
What is the SMILES notation for N-(2-hydroxy-5-nitrophenyl)nonanamide?
The canonical SMILES for N-(2-hydroxy-5-nitrophenyl)nonanamide is CCCCCCCCC(=O)Nc1cc([N+](=O)[O-])ccc1O.
What is the InChIKey of N-(2-hydroxy-5-nitrophenyl)nonanamide?
The InChIKey is NXHOADQRRFRKSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O4/c1-2-3-4-5-6-7-8-15(19)16-13-11-12(17(20)21)9-10-14(13)18/h9-11,18H,2-8H2,1H3,(H,16,19).
What are the key properties of N-(2-hydroxy-5-nitrophenyl)nonanamide?
N-(2-hydroxy-5-nitrophenyl)nonanamide has a molecular weight of 294.35 g/mol, XLogP of 3.99, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-5-nitrophenyl)nonanamide is sourced from PubChem (CID 13255814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).