N-(3-methylphenyl)-2-nitrosodecanamide

C17H26N2O2 — CID 54279753

IUPACN-(3-methylphenyl)-2-nitrosodecanamide
SMILESCCCCCCCCC(N=O)C(=O)Nc1cccc(C)c1
InChIInChI=1S/C17H26N2O2/c1-3-4-5-6-7-8-12-16(19-21)17(20)18-15-11-9-10-14(2)13-15/h9-11,13,16H,3-8,12H2,1-2H3,(H,18,20)
InChIKeyRPZGNHIRMYDHFC-UHFFFAOYSA-N
MW290.41 g/mol
LogP4.82
Rot. Bonds10

About N-(3-methylphenyl)-2-nitrosodecanamide

N-(3-methylphenyl)-2-nitrosodecanamide (PubChem CID 54279753) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-(3-methylphenyl)-2-nitrosodecanamide.

Molecular Properties

Compound NameN-(3-methylphenyl)-2-nitrosodecanamide
PubChem CID54279753
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC NameN-(3-methylphenyl)-2-nitrosodecanamide
SMILESCCCCCCCCC(N=O)C(=O)Nc1cccc(C)c1
InChIInChI=1S/C17H26N2O2/c1-3-4-5-6-7-8-12-16(19-21)17(20)18-15-11-9-10-14(2)13-15/h9-11,13,16H,3-8,12H2,1-2H3,(H,18,20)
InChIKeyRPZGNHIRMYDHFC-UHFFFAOYSA-N
XLogP4.82
TPSA58.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 54.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-ethyl-N-(3-methylphenyl)pentanamide
CID 20659416
3-dodecylsulfanyl-4-(3-methylanilino)-4-oxobutanoic acid
CID 22889843
(2S)-N-(3-methylphenyl)-2-(propylamino)propanamide
CID 76957050
N-(3-methylphenyl)-2-(propylamino)propanamide
CID 71772237
(2R)-N-(3-methylphenyl)-2-(propylamino)propanamide
CID 76957051
2-(3-methylanilino)heptanoic acid
CID 54890661
2-hexyl-1-(3-methylphenyl)guanidine
CID 111023793
2-(3-methylanilino)octan-1-ol
CID 61049186
2-amino-N-(3-methylphenyl)butanamide
CID 43649463
1-(3-methylphenyl)-3-nonylthiourea
CID 19651083
ethane;2-methyl-N-(3-methylphenyl)propanamide
CID 163229096
2-ethylsulfonyl-N-(3-methylphenyl)propanamide
CID 47207048

Frequently Asked Questions

What is the IUPAC name of N-(3-methylphenyl)-2-nitrosodecanamide?
The IUPAC name of N-(3-methylphenyl)-2-nitrosodecanamide (CID 54279753) is N-(3-methylphenyl)-2-nitrosodecanamide.
What is the SMILES notation for N-(3-methylphenyl)-2-nitrosodecanamide?
The canonical SMILES for N-(3-methylphenyl)-2-nitrosodecanamide is CCCCCCCCC(N=O)C(=O)Nc1cccc(C)c1.
What is the InChIKey of N-(3-methylphenyl)-2-nitrosodecanamide?
The InChIKey is RPZGNHIRMYDHFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-3-4-5-6-7-8-12-16(19-21)17(20)18-15-11-9-10-14(2)13-15/h9-11,13,16H,3-8,12H2,1-2H3,(H,18,20).
What are the key properties of N-(3-methylphenyl)-2-nitrosodecanamide?
N-(3-methylphenyl)-2-nitrosodecanamide has a molecular weight of 290.41 g/mol, XLogP of 4.82, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylphenyl)-2-nitrosodecanamide is sourced from PubChem (CID 54279753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).