N,N,2-triethyl-6-propylbenzamide

C16H25NO — CID 15325845

IUPACN,N,2-triethyl-6-propylbenzamide
SMILESCCCc1cccc(CC)c1C(=O)N(CC)CC
InChIInChI=1S/C16H25NO/c1-5-10-14-12-9-11-13(6-2)15(14)16(18)17(7-3)8-4/h9,11-12H,5-8,10H2,1-4H3
InChIKeyQAUVAHVVVGIMLE-UHFFFAOYSA-N
MW247.38 g/mol
LogP3.68
Rot. Bonds6

About N,N,2-triethyl-6-propylbenzamide

N,N,2-triethyl-6-propylbenzamide (PubChem CID 15325845) has the molecular formula C16H25NO and a molecular weight of 247.38 g/mol. Its IUPAC name is N,N,2-triethyl-6-propylbenzamide.

Molecular Properties

Compound NameN,N,2-triethyl-6-propylbenzamide
PubChem CID15325845
Molecular FormulaC16H25NO
Molecular Weight247.38 g/mol
Exact Mass247.19
IUPAC NameN,N,2-triethyl-6-propylbenzamide
SMILESCCCc1cccc(CC)c1C(=O)N(CC)CC
InChIInChI=1S/C16H25NO/c1-5-10-14-12-9-11-13(6-2)15(14)16(18)17(7-3)8-4/h9,11-12H,5-8,10H2,1-4H3
InChIKeyQAUVAHVVVGIMLE-UHFFFAOYSA-N
XLogP3.68
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.38
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1,1-diethyl-3-(2-propylphenyl)urea
CID 113233204
1-(2,6-diethylphenyl)ethanone
CID 14939611
2-ethoxy-6-propylbenzoic acid
CID 142472864
N,N-diethyl-2-[2-(methylamino)ethyl]benzamide
CID 104547231
N,N-diethyl-2-methyl-6-propanoylbenzamide
CID 15867089
2,6-diethylbenzoic acid;molecular nitrogen
CID 70486014
2-(2-propylphenyl)acetic acid
CID 46897017
2-chloro-N,N-diethyl-6-methylsulfanylbenzamide
CID 71442782
2-amino-N-ethyl-6-methyl-N-propylbenzamide
CID 43268247
N-ethyl-2,6-dihydroxy-N-(3-hydroxypropyl)benzamide
CID 107689617
bis(2-methyl-3-propylphenyl)methanone
CID 172692899
phosphoric acid;3-propylbenzene-1,2-diol
CID 174603816

Frequently Asked Questions

What is the IUPAC name of N,N,2-triethyl-6-propylbenzamide?
The IUPAC name of N,N,2-triethyl-6-propylbenzamide (CID 15325845) is N,N,2-triethyl-6-propylbenzamide.
What is the SMILES notation for N,N,2-triethyl-6-propylbenzamide?
The canonical SMILES for N,N,2-triethyl-6-propylbenzamide is CCCc1cccc(CC)c1C(=O)N(CC)CC.
What is the InChIKey of N,N,2-triethyl-6-propylbenzamide?
The InChIKey is QAUVAHVVVGIMLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO/c1-5-10-14-12-9-11-13(6-2)15(14)16(18)17(7-3)8-4/h9,11-12H,5-8,10H2,1-4H3.
What are the key properties of N,N,2-triethyl-6-propylbenzamide?
N,N,2-triethyl-6-propylbenzamide has a molecular weight of 247.38 g/mol, XLogP of 3.68, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,2-triethyl-6-propylbenzamide is sourced from PubChem (CID 15325845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).