2-ethyl-N-methyl-3-propylbenzamide

C13H19NO — CID 175322097

IUPAC2-ethyl-N-methyl-3-propylbenzamide
SMILESCCCc1cccc(C(=O)NC)c1CC
InChIInChI=1S/C13H19NO/c1-4-7-10-8-6-9-12(11(10)5-2)13(15)14-3/h6,8-9H,4-5,7H2,1-3H3,(H,14,15)
InChIKeyHERGSZYOLDUJNQ-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.56
Rot. Bonds4

About 2-ethyl-N-methyl-3-propylbenzamide

2-ethyl-N-methyl-3-propylbenzamide (PubChem CID 175322097) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 2-ethyl-N-methyl-3-propylbenzamide.

Molecular Properties

Compound Name2-ethyl-N-methyl-3-propylbenzamide
PubChem CID175322097
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name2-ethyl-N-methyl-3-propylbenzamide
SMILESCCCc1cccc(C(=O)NC)c1CC
InChIInChI=1S/C13H19NO/c1-4-7-10-8-6-9-12(11(10)5-2)13(15)14-3/h6,8-9H,4-5,7H2,1-3H3,(H,14,15)
InChIKeyHERGSZYOLDUJNQ-UHFFFAOYSA-N
XLogP2.56
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-benzoyl-2,3-dipropylbenzamide
CID 175499264
(2,3-dipropylphenyl)-phenylmethanone
CID 23045952
2-propylbenzohydrazide
CID 140653675
5-chloro-N-methyl-2-propylbenzamide
CID 142083181
1-(2,3-dipropylphenyl)-2-hydroxy-2-methylpropan-1-one
CID 175493914
bis(2-methyl-3-propylphenyl)methanone
CID 172692899
2-ethyl-3-(ethylcarbamoyl)benzoic acid
CID 169449850
2-ethyl-3-(3-hydroxypropyl)benzoic acid
CID 54146728
5-butyl-6-hydroxy-N-methylnaphthalene-1-carboxamide
CID 123816207
6-ethyl-N-methyl-2-oxo-5-propyl-1H-pyridine-3-carboxamide
CID 125490900
2,3-diethylbenzamide;hydrofluoride
CID 175203586
3-(methoxymethyl)-N,2-dimethylbenzamide
CID 143102947

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-methyl-3-propylbenzamide?
The IUPAC name of 2-ethyl-N-methyl-3-propylbenzamide (CID 175322097) is 2-ethyl-N-methyl-3-propylbenzamide.
What is the SMILES notation for 2-ethyl-N-methyl-3-propylbenzamide?
The canonical SMILES for 2-ethyl-N-methyl-3-propylbenzamide is CCCc1cccc(C(=O)NC)c1CC.
What is the InChIKey of 2-ethyl-N-methyl-3-propylbenzamide?
The InChIKey is HERGSZYOLDUJNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-4-7-10-8-6-9-12(11(10)5-2)13(15)14-3/h6,8-9H,4-5,7H2,1-3H3,(H,14,15).
What are the key properties of 2-ethyl-N-methyl-3-propylbenzamide?
2-ethyl-N-methyl-3-propylbenzamide has a molecular weight of 205.30 g/mol, XLogP of 2.56, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-methyl-3-propylbenzamide is sourced from PubChem (CID 175322097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).