N-ethylbenzamide

C18H22N2O2 — CID 160772566

IUPACN-ethylbenzamide
SMILESCCNC(=O)c1ccccc1.CCNC(=O)c1ccccc1
InChIInChI=1S/2C9H11NO/c2*1-2-10-9(11)8-6-4-3-5-7-8/h2*3-7H,2H2,1H3,(H,10,11)
InChIKeyRZMXZNRJTJTQTO-UHFFFAOYSA-N
MW298.39 g/mol
LogP2.87
Rot. Bonds4

About N-ethylbenzamide

N-ethylbenzamide (PubChem CID 160772566) has the molecular formula C18H22N2O2 and a molecular weight of 298.39 g/mol. Its IUPAC name is N-ethylbenzamide.

Molecular Properties

Compound NameN-ethylbenzamide
PubChem CID160772566
Molecular FormulaC18H22N2O2
Molecular Weight298.39 g/mol
Exact Mass298.17
IUPAC NameN-ethylbenzamide
SMILESCCNC(=O)c1ccccc1.CCNC(=O)c1ccccc1
InChIInChI=1S/2C9H11NO/c2*1-2-10-9(11)8-6-4-3-5-7-8/h2*3-7H,2H2,1H3,(H,10,11)
InChIKeyRZMXZNRJTJTQTO-UHFFFAOYSA-N
XLogP2.87
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethylbenzamide;hydrochloride
CID 57444995
4-benzamido-N-ethylbenzamide
CID 17153265
4-benzyl-N-ethylbenzamide
CID 134120069
N-(ethylcarbamoyl)benzamide
CID 23273840
N-ethyl-4-(phenylcarbamoylamino)benzamide
CID 17234281
3-N-[[4-[[[3-(benzylcarbamoyl)benzoyl]amino]methyl]phenyl]methyl]-1-N-ethylbenzene-1,3-dicarboxamide
CID 176788614
ethane;N-ethyl-4-hydroxybenzamide
CID 144926309
N-ethyl-2,3-diphenylquinoxaline-6-carboxamide
CID 5261756
N-ethyl-3-hydroxybenzamide
CID 13175248
benzohydrazide;propane
CID 90709051
CID 153373554
CID 153373554
N-ethyl-4-trimethylstannylbenzamide
CID 163615316

Frequently Asked Questions

What is the IUPAC name of N-ethylbenzamide?
The IUPAC name of N-ethylbenzamide (CID 160772566) is N-ethylbenzamide.
What is the SMILES notation for N-ethylbenzamide?
The canonical SMILES for N-ethylbenzamide is CCNC(=O)c1ccccc1.CCNC(=O)c1ccccc1.
What is the InChIKey of N-ethylbenzamide?
The InChIKey is RZMXZNRJTJTQTO-UHFFFAOYSA-N. The full InChI is InChI=1S/2C9H11NO/c2*1-2-10-9(11)8-6-4-3-5-7-8/h2*3-7H,2H2,1H3,(H,10,11).
What are the key properties of N-ethylbenzamide?
N-ethylbenzamide has a molecular weight of 298.39 g/mol, XLogP of 2.87, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethylbenzamide is sourced from PubChem (CID 160772566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).