N-(azetidin-3-yl)-N-ethyl-2-methoxy-5-methylbenzamide

C14H20N2O2 — CID 66181476

IUPACN-(azetidin-3-yl)-N-ethyl-2-methoxy-5-methylbenzamide
SMILESCCN(C(=O)c1cc(C)ccc1OC)C1CNC1
InChIInChI=1S/C14H20N2O2/c1-4-16(11-8-15-9-11)14(17)12-7-10(2)5-6-13(12)18-3/h5-7,11,15H,4,8-9H2,1-3H3
InChIKeyUFIFVMJWNJUMMG-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.44
Rot. Bonds4

About N-(azetidin-3-yl)-N-ethyl-2-methoxy-5-methylbenzamide

N-(azetidin-3-yl)-N-ethyl-2-methoxy-5-methylbenzamide (PubChem CID 66181476) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is N-(azetidin-3-yl)-N-ethyl-2-methoxy-5-methylbenzamide.

Molecular Properties

Compound NameN-(azetidin-3-yl)-N-ethyl-2-methoxy-5-methylbenzamide
PubChem CID66181476
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC NameN-(azetidin-3-yl)-N-ethyl-2-methoxy-5-methylbenzamide
SMILESCCN(C(=O)c1cc(C)ccc1OC)C1CNC1
InChIInChI=1S/C14H20N2O2/c1-4-16(11-8-15-9-11)14(17)12-7-10(2)5-6-13(12)18-3/h5-7,11,15H,4,8-9H2,1-3H3
InChIKeyUFIFVMJWNJUMMG-UHFFFAOYSA-N
XLogP1.44
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(azetidin-3-yl)-N-ethyl-2-methoxybenzamide
CID 66182739
N-(azetidin-3-yl)-N-ethyl-5-methyl-2-nitrobenzamide
CID 66182534
5-amino-N-cyclopentyl-N-ethyl-2-methoxybenzamide
CID 61094826
N-(azetidin-3-yl)-N-ethyl-2-hydroxy-4-methoxybenzamide
CID 66184450
N-ethyl-2-fluoro-5-methyl-N-pyrrolidin-3-ylbenzamide
CID 62514257
N-ethyl-2-methoxy-5-methyl-N-(piperidin-3-ylmethyl)benzamide
CID 106629432
N-(azetidin-3-yl)-N-ethyl-3-methylbenzamide
CID 66181460
N-(3-aminopropyl)-N-cyclopentyl-2-methoxy-5-methylbenzamide
CID 62504725
N-cyclopentyl-N-ethyl-2,4,5-trimethoxybenzamide
CID 52574017
N-ethyl-2,4-dimethyl-N-piperidin-4-ylbenzamide
CID 60807085
2-methoxy-5-methyl-N,N-dipropylbenzamide
CID 110761077
N-(azetidin-3-yl)-2-chloro-N-ethylbenzamide
CID 66182738

Frequently Asked Questions

What is the IUPAC name of N-(azetidin-3-yl)-N-ethyl-2-methoxy-5-methylbenzamide?
The IUPAC name of N-(azetidin-3-yl)-N-ethyl-2-methoxy-5-methylbenzamide (CID 66181476) is N-(azetidin-3-yl)-N-ethyl-2-methoxy-5-methylbenzamide.
What is the SMILES notation for N-(azetidin-3-yl)-N-ethyl-2-methoxy-5-methylbenzamide?
The canonical SMILES for N-(azetidin-3-yl)-N-ethyl-2-methoxy-5-methylbenzamide is CCN(C(=O)c1cc(C)ccc1OC)C1CNC1.
What is the InChIKey of N-(azetidin-3-yl)-N-ethyl-2-methoxy-5-methylbenzamide?
The InChIKey is UFIFVMJWNJUMMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-4-16(11-8-15-9-11)14(17)12-7-10(2)5-6-13(12)18-3/h5-7,11,15H,4,8-9H2,1-3H3.
What are the key properties of N-(azetidin-3-yl)-N-ethyl-2-methoxy-5-methylbenzamide?
N-(azetidin-3-yl)-N-ethyl-2-methoxy-5-methylbenzamide has a molecular weight of 248.33 g/mol, XLogP of 1.44, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(azetidin-3-yl)-N-ethyl-2-methoxy-5-methylbenzamide is sourced from PubChem (CID 66181476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).