N-cyclopropyl-2,4-dimethoxybenzamide

C12H15NO3 — CID 4576292

IUPACN-cyclopropyl-2,4-dimethoxybenzamide
SMILESCOc1ccc(C(=O)NC2CC2)c(OC)c1
InChIInChI=1S/C12H15NO3/c1-15-9-5-6-10(11(7-9)16-2)12(14)13-8-3-4-8/h5-8H,3-4H2,1-2H3,(H,13,14)
InChIKeyJNJVWNMGTWABLB-UHFFFAOYSA-N
MW221.26 g/mol
LogP1.60
Rot. Bonds4

About N-cyclopropyl-2,4-dimethoxybenzamide

N-cyclopropyl-2,4-dimethoxybenzamide (PubChem CID 4576292) has the molecular formula C12H15NO3 and a molecular weight of 221.26 g/mol. Its IUPAC name is N-cyclopropyl-2,4-dimethoxybenzamide.

Molecular Properties

Compound NameN-cyclopropyl-2,4-dimethoxybenzamide
PubChem CID4576292
Molecular FormulaC12H15NO3
Molecular Weight221.26 g/mol
Exact Mass221.11
IUPAC NameN-cyclopropyl-2,4-dimethoxybenzamide
SMILESCOc1ccc(C(=O)NC2CC2)c(OC)c1
InChIInChI=1S/C12H15NO3/c1-15-9-5-6-10(11(7-9)16-2)12(14)13-8-3-4-8/h5-8H,3-4H2,1-2H3,(H,13,14)
InChIKeyJNJVWNMGTWABLB-UHFFFAOYSA-N
XLogP1.60
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4,4-difluorocyclohexyl)-2,4-dimethoxybenzamide
CID 119104693
N-cyclopropyl-4-fluoro-2-methoxybenzamide
CID 162421278
N-(4-chlorocyclohexyl)-2,5-dimethoxybenzamide
CID 114296927
N-[4-(5-chloropyrimidin-2-yl)oxycyclohexyl]-2,4-dimethoxybenzamide
CID 90633687
N-[3-(cyclopropylamino)propyl]-2,4-dimethoxybenzamide
CID 43596570
N-cyclohexyl-2,5-dimethoxybenzamide
CID 8573659
2,4-dimethoxy-N-[(1S,2R)-2-methylcyclohexyl]benzamide
CID 40793133
2-methoxy-N-[4-[(2-methoxybenzoyl)amino]cyclohexyl]benzamide
CID 1235931
1-N-cyclopropyl-4-N-(2,4-dimethoxyphenyl)benzene-1,4-dicarboxamide
CID 109043393
4-[(2-hydroxy-4-methoxybenzoyl)amino]cyclohexane-1-carboxylic acid
CID 60810345
N-(4-bromocyclohexyl)-2-fluoro-4-methoxybenzamide
CID 102885227
4-[(4-methoxy-2-methylbenzoyl)amino]cyclohexane-1-carboxylic acid
CID 119228986

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2,4-dimethoxybenzamide?
The IUPAC name of N-cyclopropyl-2,4-dimethoxybenzamide (CID 4576292) is N-cyclopropyl-2,4-dimethoxybenzamide.
What is the SMILES notation for N-cyclopropyl-2,4-dimethoxybenzamide?
The canonical SMILES for N-cyclopropyl-2,4-dimethoxybenzamide is COc1ccc(C(=O)NC2CC2)c(OC)c1.
What is the InChIKey of N-cyclopropyl-2,4-dimethoxybenzamide?
The InChIKey is JNJVWNMGTWABLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO3/c1-15-9-5-6-10(11(7-9)16-2)12(14)13-8-3-4-8/h5-8H,3-4H2,1-2H3,(H,13,14).
What are the key properties of N-cyclopropyl-2,4-dimethoxybenzamide?
N-cyclopropyl-2,4-dimethoxybenzamide has a molecular weight of 221.26 g/mol, XLogP of 1.60, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2,4-dimethoxybenzamide is sourced from PubChem (CID 4576292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).