N-[2-(ethylaminomethyl)phenyl]nonanamide

C18H30N2O — CID 65425982

IUPACN-[2-(ethylaminomethyl)phenyl]nonanamide
SMILESCCCCCCCCC(=O)Nc1ccccc1CNCC
InChIInChI=1S/C18H30N2O/c1-3-5-6-7-8-9-14-18(21)20-17-13-11-10-12-16(17)15-19-4-2/h10-13,19H,3-9,14-15H2,1-2H3,(H,20,21)
InChIKeyWBZKVCYASYMKOK-UHFFFAOYSA-N
MW290.45 g/mol
LogP4.49
Rot. Bonds11

About N-[2-(ethylaminomethyl)phenyl]nonanamide

N-[2-(ethylaminomethyl)phenyl]nonanamide (PubChem CID 65425982) has the molecular formula C18H30N2O and a molecular weight of 290.45 g/mol. Its IUPAC name is N-[2-(ethylaminomethyl)phenyl]nonanamide.

Molecular Properties

Compound NameN-[2-(ethylaminomethyl)phenyl]nonanamide
PubChem CID65425982
Molecular FormulaC18H30N2O
Molecular Weight290.45 g/mol
Exact Mass290.24
IUPAC NameN-[2-(ethylaminomethyl)phenyl]nonanamide
SMILESCCCCCCCCC(=O)Nc1ccccc1CNCC
InChIInChI=1S/C18H30N2O/c1-3-5-6-7-8-9-14-18(21)20-17-13-11-10-12-16(17)15-19-4-2/h10-13,19H,3-9,14-15H2,1-2H3,(H,20,21)
InChIKeyWBZKVCYASYMKOK-UHFFFAOYSA-N
XLogP4.49
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 54.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(ethylaminomethyl)phenyl]pentanamide;hydrochloride
CID 119438958
N-(2-ethylphenyl)undecanamide
CID 5078439
N-(2-ethylphenyl)heptanamide
CID 4582103
N'-[2-(ethylaminomethyl)phenyl]-N-propylpentanediamide;hydrochloride
CID 119440586
N-[2-(ethylaminomethyl)phenyl]-5,5-dimethylhexanamide
CID 119440882
N-[2-(ethylaminomethyl)phenyl]pent-4-enamide
CID 62678727
N-[2-(ethylaminomethyl)phenyl]-4-oxo-4-phenylbutanamide
CID 119440695
N-[2-(ethylaminomethyl)phenyl]pent-4-ynamide
CID 114028604
N-[2-(methanesulfinamidomethyl)phenyl]pentanamide
CID 167063111
N-(2-chlorophenyl)octanamide
CID 2292983
N-naphthalen-1-yldodecanamide
CID 588517
N-(2-aminophenyl)octadecanamide
CID 68839220

Frequently Asked Questions

What is the IUPAC name of N-[2-(ethylaminomethyl)phenyl]nonanamide?
The IUPAC name of N-[2-(ethylaminomethyl)phenyl]nonanamide (CID 65425982) is N-[2-(ethylaminomethyl)phenyl]nonanamide.
What is the SMILES notation for N-[2-(ethylaminomethyl)phenyl]nonanamide?
The canonical SMILES for N-[2-(ethylaminomethyl)phenyl]nonanamide is CCCCCCCCC(=O)Nc1ccccc1CNCC.
What is the InChIKey of N-[2-(ethylaminomethyl)phenyl]nonanamide?
The InChIKey is WBZKVCYASYMKOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2O/c1-3-5-6-7-8-9-14-18(21)20-17-13-11-10-12-16(17)15-19-4-2/h10-13,19H,3-9,14-15H2,1-2H3,(H,20,21).
What are the key properties of N-[2-(ethylaminomethyl)phenyl]nonanamide?
N-[2-(ethylaminomethyl)phenyl]nonanamide has a molecular weight of 290.45 g/mol, XLogP of 4.49, 11 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(ethylaminomethyl)phenyl]nonanamide is sourced from PubChem (CID 65425982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).