N-(3-amino-2,6-dimethylphenyl)decanamide

C18H30N2O — CID 65448531

IUPACN-(3-amino-2,6-dimethylphenyl)decanamide
SMILESCCCCCCCCCC(=O)Nc1c(C)ccc(N)c1C
InChIInChI=1S/C18H30N2O/c1-4-5-6-7-8-9-10-11-17(21)20-18-14(2)12-13-16(19)15(18)3/h12-13H,4-11,19H2,1-3H3,(H,20,21)
InChIKeyOZHKJWSBGDDMGZ-UHFFFAOYSA-N
MW290.45 g/mol
LogP4.96
Rot. Bonds9

About N-(3-amino-2,6-dimethylphenyl)decanamide

N-(3-amino-2,6-dimethylphenyl)decanamide (PubChem CID 65448531) has the molecular formula C18H30N2O and a molecular weight of 290.45 g/mol. Its IUPAC name is N-(3-amino-2,6-dimethylphenyl)decanamide.

Molecular Properties

Compound NameN-(3-amino-2,6-dimethylphenyl)decanamide
PubChem CID65448531
Molecular FormulaC18H30N2O
Molecular Weight290.45 g/mol
Exact Mass290.24
IUPAC NameN-(3-amino-2,6-dimethylphenyl)decanamide
SMILESCCCCCCCCCC(=O)Nc1c(C)ccc(N)c1C
InChIInChI=1S/C18H30N2O/c1-4-5-6-7-8-9-10-11-17(21)20-18-14(2)12-13-16(19)15(18)3/h12-13H,4-11,19H2,1-3H3,(H,20,21)
InChIKeyOZHKJWSBGDDMGZ-UHFFFAOYSA-N
XLogP4.96
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 54.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(3-amino-2,6-dimethylphenyl)butanamide
CID 24711453
N-(2,6-dimethylphenyl)tetradecanamide
CID 54789598
N-[2,3,5,6-tetramethyl-4-(undecanoylamino)phenyl]undecanamide
CID 100965559
N-[2-(decanoylamino)-3,4,5,6-tetramethylphenyl]decanamide
CID 101068768
N-(2-ethyl-6-methylphenyl)tetradecanamide
CID 54789893
N-(3-amino-2,6-dimethylphenyl)-2-ethoxyacetamide
CID 28776914
1-(3-amino-2,6-dimethylphenyl)-3-propylurea
CID 28785713
N-(2-amino-5-methylphenyl)heptanamide
CID 114752035
N-[3-[[2-(diethylamino)acetyl]amino]-2,4-dimethylphenyl]tetradecanamide
CID 67352086
2-(hexadecanoylamino)-3-methylbenzoic acid
CID 12800042
(3-amino-2,6-dimethylphenyl)urea
CID 19820899
N-(2-methyl-6-propan-2-ylphenyl)decanamide
CID 3411920

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2,6-dimethylphenyl)decanamide?
The IUPAC name of N-(3-amino-2,6-dimethylphenyl)decanamide (CID 65448531) is N-(3-amino-2,6-dimethylphenyl)decanamide.
What is the SMILES notation for N-(3-amino-2,6-dimethylphenyl)decanamide?
The canonical SMILES for N-(3-amino-2,6-dimethylphenyl)decanamide is CCCCCCCCCC(=O)Nc1c(C)ccc(N)c1C.
What is the InChIKey of N-(3-amino-2,6-dimethylphenyl)decanamide?
The InChIKey is OZHKJWSBGDDMGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2O/c1-4-5-6-7-8-9-10-11-17(21)20-18-14(2)12-13-16(19)15(18)3/h12-13H,4-11,19H2,1-3H3,(H,20,21).
What are the key properties of N-(3-amino-2,6-dimethylphenyl)decanamide?
N-(3-amino-2,6-dimethylphenyl)decanamide has a molecular weight of 290.45 g/mol, XLogP of 4.96, 9 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2,6-dimethylphenyl)decanamide is sourced from PubChem (CID 65448531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).