4-(methoxymethyl)-N-(4-methylpiperazin-1-yl)benzamide

C14H21N3O2 — CID 9205030

IUPAC4-(methoxymethyl)-N-(4-methylpiperazin-1-yl)benzamide
SMILESCOCc1ccc(C(=O)NN2CCN(C)CC2)cc1
InChIInChI=1S/C14H21N3O2/c1-16-7-9-17(10-8-16)15-14(18)13-5-3-12(4-6-13)11-19-2/h3-6H,7-11H2,1-2H3,(H,15,18)
InChIKeyOXPVWFQNAIGVMJ-UHFFFAOYSA-N
MW263.34 g/mol
LogP0.73
Rot. Bonds4

About 4-(methoxymethyl)-N-(4-methylpiperazin-1-yl)benzamide

4-(methoxymethyl)-N-(4-methylpiperazin-1-yl)benzamide (PubChem CID 9205030) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is 4-(methoxymethyl)-N-(4-methylpiperazin-1-yl)benzamide.

Molecular Properties

Compound Name4-(methoxymethyl)-N-(4-methylpiperazin-1-yl)benzamide
PubChem CID9205030
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC Name4-(methoxymethyl)-N-(4-methylpiperazin-1-yl)benzamide
SMILESCOCc1ccc(C(=O)NN2CCN(C)CC2)cc1
InChIInChI=1S/C14H21N3O2/c1-16-7-9-17(10-8-16)15-14(18)13-5-3-12(4-6-13)11-19-2/h3-6H,7-11H2,1-2H3,(H,15,18)
InChIKeyOXPVWFQNAIGVMJ-UHFFFAOYSA-N
XLogP0.73
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-methoxy-N-(4-methylpiperazin-1-yl)benzamide
CID 4605350
4-[(4-methylpiperazin-1-yl)carbamoyl]benzoic acid
CID 83023034
N-(4-methylpiperazin-1-yl)-4-(naphthalen-2-yloxymethyl)benzamide
CID 19578268
4-[methoxy(methyl)sulfamoyl]-N-(4-methylpiperazin-1-yl)benzamide
CID 9205648
N'-(4-fluorobenzoyl)-4-(methoxymethyl)benzohydrazide
CID 8573769
N-[4-(4-ethylpiperazin-1-yl)butyl]-4-(methoxymethyl)benzamide
CID 56812631
4-(methoxymethyl)-N-(3-piperazin-1-ylpropyl)benzamide
CID 119393714
3-methyl-N-(4-methylpiperazin-1-yl)benzamide
CID 872229
4-(methoxymethyl)-N-[(4-pyrrolidin-1-ylphenyl)methyl]benzamide
CID 35613985
N-(2,3-dihydro-1H-inden-5-yl)-4-(methoxymethyl)benzamide
CID 42466710
5-[(2-methoxyphenoxy)methyl]-N-(4-methylpiperazin-1-yl)furan-2-carboxamide
CID 3542536
N-[4-[(4-methylpiperazin-1-yl)carbamoyl]phenyl]thiophene-2-carboxamide
CID 9205772

Frequently Asked Questions

What is the IUPAC name of 4-(methoxymethyl)-N-(4-methylpiperazin-1-yl)benzamide?
The IUPAC name of 4-(methoxymethyl)-N-(4-methylpiperazin-1-yl)benzamide (CID 9205030) is 4-(methoxymethyl)-N-(4-methylpiperazin-1-yl)benzamide.
What is the SMILES notation for 4-(methoxymethyl)-N-(4-methylpiperazin-1-yl)benzamide?
The canonical SMILES for 4-(methoxymethyl)-N-(4-methylpiperazin-1-yl)benzamide is COCc1ccc(C(=O)NN2CCN(C)CC2)cc1.
What is the InChIKey of 4-(methoxymethyl)-N-(4-methylpiperazin-1-yl)benzamide?
The InChIKey is OXPVWFQNAIGVMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-16-7-9-17(10-8-16)15-14(18)13-5-3-12(4-6-13)11-19-2/h3-6H,7-11H2,1-2H3,(H,15,18).
What are the key properties of 4-(methoxymethyl)-N-(4-methylpiperazin-1-yl)benzamide?
4-(methoxymethyl)-N-(4-methylpiperazin-1-yl)benzamide has a molecular weight of 263.34 g/mol, XLogP of 0.73, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methoxymethyl)-N-(4-methylpiperazin-1-yl)benzamide is sourced from PubChem (CID 9205030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).