N-[(1,4-dimethylpiperazin-2-yl)methyl]-2-hydroxy-3-methoxybenzamide

C15H23N3O3 — CID 63898434

IUPACN-[(1,4-dimethylpiperazin-2-yl)methyl]-2-hydroxy-3-methoxybenzamide
SMILESCOc1cccc(C(=O)NCC2CN(C)CCN2C)c1O
InChIInChI=1S/C15H23N3O3/c1-17-7-8-18(2)11(10-17)9-16-15(20)12-5-4-6-13(21-3)14(12)19/h4-6,11,19H,7-10H2,1-3H3,(H,16,20)
InChIKeyORCRRZCMWWARNR-UHFFFAOYSA-N
MW293.37 g/mol
LogP0.38
Rot. Bonds4

About N-[(1,4-dimethylpiperazin-2-yl)methyl]-2-hydroxy-3-methoxybenzamide

N-[(1,4-dimethylpiperazin-2-yl)methyl]-2-hydroxy-3-methoxybenzamide (PubChem CID 63898434) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is N-[(1,4-dimethylpiperazin-2-yl)methyl]-2-hydroxy-3-methoxybenzamide.

Molecular Properties

Compound NameN-[(1,4-dimethylpiperazin-2-yl)methyl]-2-hydroxy-3-methoxybenzamide
PubChem CID63898434
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC NameN-[(1,4-dimethylpiperazin-2-yl)methyl]-2-hydroxy-3-methoxybenzamide
SMILESCOc1cccc(C(=O)NCC2CN(C)CCN2C)c1O
InChIInChI=1S/C15H23N3O3/c1-17-7-8-18(2)11(10-17)9-16-15(20)12-5-4-6-13(21-3)14(12)19/h4-6,11,19H,7-10H2,1-3H3,(H,16,20)
InChIKeyORCRRZCMWWARNR-UHFFFAOYSA-N
XLogP0.38
TPSA65.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(1,4-dimethylpiperazin-2-yl)methyl]-3-hydroxy-2-methylbenzamide
CID 82829349
2-hydroxy-3-methoxy-N-[(4-methylcyclohexyl)methyl]benzamide
CID 61380888
N-[(1,4-dimethylpiperazin-2-yl)methyl]-2-fluoro-6-hydroxybenzamide
CID 104917543
N-[(1,4-dimethylpiperazin-2-yl)methyl]-1-oxo-2,3-dihydroindene-4-carboxamide
CID 131902065
4-amino-N-[(1,4-dimethylpiperazin-2-yl)methyl]-3-methoxybenzamide
CID 104782948
2-methoxy-N-[(1-methylpyrrolidin-2-yl)methyl]benzamide
CID 47416436
N-[(3-chlorocyclohexyl)methyl]-2-hydroxy-3-methoxybenzamide
CID 106132057
2-hydroxy-3-methoxy-N-(2-pyrrolidin-1-ylethyl)benzamide
CID 60682639
2-hydroxy-3-methoxy-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]benzamide
CID 63234295
N-[(1,4-dimethylpiperazin-2-yl)methyl]-2-(ethylamino)pyridine-3-carboxamide
CID 63897320
2-amino-N-[(1,4-dimethylpiperazin-2-yl)methyl]-5-methylbenzamide
CID 63897503
4-amino-N-[(1,4-dimethylpiperazin-2-yl)methyl]benzamide
CID 63884571

Frequently Asked Questions

What is the IUPAC name of N-[(1,4-dimethylpiperazin-2-yl)methyl]-2-hydroxy-3-methoxybenzamide?
The IUPAC name of N-[(1,4-dimethylpiperazin-2-yl)methyl]-2-hydroxy-3-methoxybenzamide (CID 63898434) is N-[(1,4-dimethylpiperazin-2-yl)methyl]-2-hydroxy-3-methoxybenzamide.
What is the SMILES notation for N-[(1,4-dimethylpiperazin-2-yl)methyl]-2-hydroxy-3-methoxybenzamide?
The canonical SMILES for N-[(1,4-dimethylpiperazin-2-yl)methyl]-2-hydroxy-3-methoxybenzamide is COc1cccc(C(=O)NCC2CN(C)CCN2C)c1O.
What is the InChIKey of N-[(1,4-dimethylpiperazin-2-yl)methyl]-2-hydroxy-3-methoxybenzamide?
The InChIKey is ORCRRZCMWWARNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3/c1-17-7-8-18(2)11(10-17)9-16-15(20)12-5-4-6-13(21-3)14(12)19/h4-6,11,19H,7-10H2,1-3H3,(H,16,20).
What are the key properties of N-[(1,4-dimethylpiperazin-2-yl)methyl]-2-hydroxy-3-methoxybenzamide?
N-[(1,4-dimethylpiperazin-2-yl)methyl]-2-hydroxy-3-methoxybenzamide has a molecular weight of 293.37 g/mol, XLogP of 0.38, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1,4-dimethylpiperazin-2-yl)methyl]-2-hydroxy-3-methoxybenzamide is sourced from PubChem (CID 63898434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).