N-methyl-4-(oxetan-3-yl)benzamide

C11H13NO2 — CID 170761972

IUPACN-methyl-4-(oxetan-3-yl)benzamide
SMILESCNC(=O)c1ccc(C2COC2)cc1
InChIInChI=1S/C11H13NO2/c1-12-11(13)9-4-2-8(3-5-9)10-6-14-7-10/h2-5,10H,6-7H2,1H3,(H,12,13)
InChIKeyNCYRBWJYMSIDQA-UHFFFAOYSA-N
MW191.23 g/mol
LogP1.16
Rot. Bonds2

About N-methyl-4-(oxetan-3-yl)benzamide

N-methyl-4-(oxetan-3-yl)benzamide (PubChem CID 170761972) has the molecular formula C11H13NO2 and a molecular weight of 191.23 g/mol. Its IUPAC name is N-methyl-4-(oxetan-3-yl)benzamide.

Molecular Properties

Compound NameN-methyl-4-(oxetan-3-yl)benzamide
PubChem CID170761972
Molecular FormulaC11H13NO2
Molecular Weight191.23 g/mol
Exact Mass191.09
IUPAC NameN-methyl-4-(oxetan-3-yl)benzamide
SMILESCNC(=O)c1ccc(C2COC2)cc1
InChIInChI=1S/C11H13NO2/c1-12-11(13)9-4-2-8(3-5-9)10-6-14-7-10/h2-5,10H,6-7H2,1H3,(H,12,13)
InChIKeyNCYRBWJYMSIDQA-UHFFFAOYSA-N
XLogP1.16
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-4-(oxetan-3-yl)benzamide?
The IUPAC name of N-methyl-4-(oxetan-3-yl)benzamide (CID 170761972) is N-methyl-4-(oxetan-3-yl)benzamide.
What is the SMILES notation for N-methyl-4-(oxetan-3-yl)benzamide?
The canonical SMILES for N-methyl-4-(oxetan-3-yl)benzamide is CNC(=O)c1ccc(C2COC2)cc1.
What is the InChIKey of N-methyl-4-(oxetan-3-yl)benzamide?
The InChIKey is NCYRBWJYMSIDQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO2/c1-12-11(13)9-4-2-8(3-5-9)10-6-14-7-10/h2-5,10H,6-7H2,1H3,(H,12,13).
What are the key properties of N-methyl-4-(oxetan-3-yl)benzamide?
N-methyl-4-(oxetan-3-yl)benzamide has a molecular weight of 191.23 g/mol, XLogP of 1.16, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-(oxetan-3-yl)benzamide is sourced from PubChem (CID 170761972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).