2-bromo-5-methoxy-N-(1-methylcyclopropyl)benzamide

C12H14BrNO2 — CID 115634288

IUPAC2-bromo-5-methoxy-N-(1-methylcyclopropyl)benzamide
SMILESCOc1ccc(Br)c(C(=O)NC2(C)CC2)c1
InChIInChI=1S/C12H14BrNO2/c1-12(5-6-12)14-11(15)9-7-8(16-2)3-4-10(9)13/h3-4,7H,5-6H2,1-2H3,(H,14,15)
InChIKeySSEBDNUOWNRCJW-UHFFFAOYSA-N
MW284.15 g/mol
LogP2.74
Rot. Bonds3

About 2-bromo-5-methoxy-N-(1-methylcyclopropyl)benzamide

2-bromo-5-methoxy-N-(1-methylcyclopropyl)benzamide (PubChem CID 115634288) has the molecular formula C12H14BrNO2 and a molecular weight of 284.15 g/mol. Its IUPAC name is 2-bromo-5-methoxy-N-(1-methylcyclopropyl)benzamide.

Molecular Properties

Compound Name2-bromo-5-methoxy-N-(1-methylcyclopropyl)benzamide
PubChem CID115634288
Molecular FormulaC12H14BrNO2
Molecular Weight284.15 g/mol
Exact Mass283.02
IUPAC Name2-bromo-5-methoxy-N-(1-methylcyclopropyl)benzamide
SMILESCOc1ccc(Br)c(C(=O)NC2(C)CC2)c1
InChIInChI=1S/C12H14BrNO2/c1-12(5-6-12)14-11(15)9-7-8(16-2)3-4-10(9)13/h3-4,7H,5-6H2,1-2H3,(H,14,15)
InChIKeySSEBDNUOWNRCJW-UHFFFAOYSA-N
XLogP2.74
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.15
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-[(2-bromo-5-methoxybenzoyl)amino]cyclopentyl]acetic acid
CID 64671810
2-bromo-N-(1-cyanocycloheptyl)-5-methoxybenzamide
CID 60967528
2-bromo-5-methoxy-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide
CID 113252964
2-hydroxy-4-methoxy-N-(1-methylcyclobutyl)benzamide
CID 113346628
2-bromo-5-methyl-N-(1-methylcyclopentyl)benzamide
CID 80987670
2-bromo-5-methoxy-N-[3-(methylamino)propyl]benzamide
CID 43600621
2-bromo-5-methyl-N-(1-methylcyclohexyl)benzamide
CID 80972166
2-bromo-5-methoxy-N-[3-(methylamino)propyl]benzamide;hydrochloride
CID 119429716
2-bromo-5-fluoro-N-(1-methylcyclohexyl)benzamide
CID 61217018
2-bromo-5-methoxy-N-(4-propan-2-yloxyphenyl)benzamide
CID 55749089
1-[(2-amino-5-methoxybenzoyl)amino]cyclopropane-1-carboxylic acid
CID 115413408
methyl 2-[(2-bromo-5-methoxybenzoyl)amino]-3-methylbutanoate
CID 43404116

Frequently Asked Questions

What is the IUPAC name of 2-bromo-5-methoxy-N-(1-methylcyclopropyl)benzamide?
The IUPAC name of 2-bromo-5-methoxy-N-(1-methylcyclopropyl)benzamide (CID 115634288) is 2-bromo-5-methoxy-N-(1-methylcyclopropyl)benzamide.
What is the SMILES notation for 2-bromo-5-methoxy-N-(1-methylcyclopropyl)benzamide?
The canonical SMILES for 2-bromo-5-methoxy-N-(1-methylcyclopropyl)benzamide is COc1ccc(Br)c(C(=O)NC2(C)CC2)c1.
What is the InChIKey of 2-bromo-5-methoxy-N-(1-methylcyclopropyl)benzamide?
The InChIKey is SSEBDNUOWNRCJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14BrNO2/c1-12(5-6-12)14-11(15)9-7-8(16-2)3-4-10(9)13/h3-4,7H,5-6H2,1-2H3,(H,14,15).
What are the key properties of 2-bromo-5-methoxy-N-(1-methylcyclopropyl)benzamide?
2-bromo-5-methoxy-N-(1-methylcyclopropyl)benzamide has a molecular weight of 284.15 g/mol, XLogP of 2.74, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-5-methoxy-N-(1-methylcyclopropyl)benzamide is sourced from PubChem (CID 115634288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).