N-(azetidin-3-yl)-5-chloro-2-methoxybenzamide

C11H13ClN2O2 — CID 66186533

IUPACN-(azetidin-3-yl)-5-chloro-2-methoxybenzamide
SMILESCOc1ccc(Cl)cc1C(=O)NC1CNC1
InChIInChI=1S/C11H13ClN2O2/c1-16-10-3-2-7(12)4-9(10)11(15)14-8-5-13-6-8/h2-4,8,13H,5-6H2,1H3,(H,14,15)
InChIKeyXNPMUJAEVNAQAN-UHFFFAOYSA-N
MW240.69 g/mol
LogP1.05
Rot. Bonds3

About N-(azetidin-3-yl)-5-chloro-2-methoxybenzamide

N-(azetidin-3-yl)-5-chloro-2-methoxybenzamide (PubChem CID 66186533) has the molecular formula C11H13ClN2O2 and a molecular weight of 240.69 g/mol. Its IUPAC name is N-(azetidin-3-yl)-5-chloro-2-methoxybenzamide.

Molecular Properties

Compound NameN-(azetidin-3-yl)-5-chloro-2-methoxybenzamide
PubChem CID66186533
Molecular FormulaC11H13ClN2O2
Molecular Weight240.69 g/mol
Exact Mass240.07
IUPAC NameN-(azetidin-3-yl)-5-chloro-2-methoxybenzamide
SMILESCOc1ccc(Cl)cc1C(=O)NC1CNC1
InChIInChI=1S/C11H13ClN2O2/c1-16-10-3-2-7(12)4-9(10)11(15)14-8-5-13-6-8/h2-4,8,13H,5-6H2,1H3,(H,14,15)
InChIKeyXNPMUJAEVNAQAN-UHFFFAOYSA-N
XLogP1.05
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.69
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-2-methoxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzamide
CID 848313
5-chloro-2-methoxy-N-[1-(2-methylpropanoyl)piperidin-4-yl]benzamide
CID 32541177
5-chloro-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]-2-methoxybenzamide
CID 108552297
5-chloro-2-methoxy-N-(3-methylpiperidin-4-yl)benzamide;hydrochloride
CID 120556533
N-(2-aminocyclopropyl)-5-chloro-2-methoxybenzamide
CID 43593837
4-chloro-2-methoxy-N-piperidin-3-ylbenzamide
CID 63321384
5-chloro-2-propan-2-yloxy-N-pyrrolidin-3-ylbenzamide
CID 119449786
5-chloro-N'-(5-chloro-2-methoxybenzoyl)-2-methoxybenzohydrazide
CID 7922079
5-chloro-N-[1-(2,6-dimethoxybenzoyl)piperidin-4-yl]-2-methoxybenzamide
CID 108552221
5-chloro-N-[(3S)-1-(3,4-dimethoxyphenyl)-5-oxopyrrolidin-3-yl]-2-methoxybenzamide
CID 7255711
5-chloro-N-[(1R,2R)-2-hydroxycyclohexyl]-2-methoxybenzamide
CID 94413829
5-chloro-N-[1-(3,5-dihydroxybenzoyl)piperidin-4-yl]-2-methoxybenzamide
CID 108552291

Frequently Asked Questions

What is the IUPAC name of N-(azetidin-3-yl)-5-chloro-2-methoxybenzamide?
The IUPAC name of N-(azetidin-3-yl)-5-chloro-2-methoxybenzamide (CID 66186533) is N-(azetidin-3-yl)-5-chloro-2-methoxybenzamide.
What is the SMILES notation for N-(azetidin-3-yl)-5-chloro-2-methoxybenzamide?
The canonical SMILES for N-(azetidin-3-yl)-5-chloro-2-methoxybenzamide is COc1ccc(Cl)cc1C(=O)NC1CNC1.
What is the InChIKey of N-(azetidin-3-yl)-5-chloro-2-methoxybenzamide?
The InChIKey is XNPMUJAEVNAQAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13ClN2O2/c1-16-10-3-2-7(12)4-9(10)11(15)14-8-5-13-6-8/h2-4,8,13H,5-6H2,1H3,(H,14,15).
What are the key properties of N-(azetidin-3-yl)-5-chloro-2-methoxybenzamide?
N-(azetidin-3-yl)-5-chloro-2-methoxybenzamide has a molecular weight of 240.69 g/mol, XLogP of 1.05, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(azetidin-3-yl)-5-chloro-2-methoxybenzamide is sourced from PubChem (CID 66186533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).