N-(4-methylpiperazin-1-yl)-4-(naphthalen-2-yloxymethyl)benzamide

C23H25N3O2 — CID 19578268

IUPACN-(4-methylpiperazin-1-yl)-4-(naphthalen-2-yloxymethyl)benzamide
SMILESCN1CCN(NC(=O)c2ccc(COc3ccc4ccccc4c3)cc2)CC1
InChIInChI=1S/C23H25N3O2/c1-25-12-14-26(15-13-25)24-23(27)20-8-6-18(7-9-20)17-28-22-11-10-19-4-2-3-5-21(19)16-22/h2-11,16H,12-15,17H2,1H3,(H,24,27)
InChIKeyAONCVIMWCXWJDV-UHFFFAOYSA-N
MW375.47 g/mol
LogP3.31
Rot. Bonds5

About N-(4-methylpiperazin-1-yl)-4-(naphthalen-2-yloxymethyl)benzamide

N-(4-methylpiperazin-1-yl)-4-(naphthalen-2-yloxymethyl)benzamide (PubChem CID 19578268) has the molecular formula C23H25N3O2 and a molecular weight of 375.47 g/mol. Its IUPAC name is N-(4-methylpiperazin-1-yl)-4-(naphthalen-2-yloxymethyl)benzamide.

Molecular Properties

Compound NameN-(4-methylpiperazin-1-yl)-4-(naphthalen-2-yloxymethyl)benzamide
PubChem CID19578268
Molecular FormulaC23H25N3O2
Molecular Weight375.47 g/mol
Exact Mass375.19
IUPAC NameN-(4-methylpiperazin-1-yl)-4-(naphthalen-2-yloxymethyl)benzamide
SMILESCN1CCN(NC(=O)c2ccc(COc3ccc4ccccc4c3)cc2)CC1
InChIInChI=1S/C23H25N3O2/c1-25-12-14-26(15-13-25)24-23(27)20-8-6-18(7-9-20)17-28-22-11-10-19-4-2-3-5-21(19)16-22/h2-11,16H,12-15,17H2,1H3,(H,24,27)
InChIKeyAONCVIMWCXWJDV-UHFFFAOYSA-N
XLogP3.31
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.47
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(methoxymethyl)-N-(4-methylpiperazin-1-yl)benzamide
CID 9205030
4-methoxy-N-(4-methylpiperazin-1-yl)benzamide
CID 4605350
7-phenylmethoxynaphthalene-2-carboxylic acid
CID 22243430
2-[4-(naphthalen-2-yloxymethyl)phenyl]acetic acid
CID 20984477
1-methyl-4-[(7-phenylmethoxynaphthalen-2-yl)methyl]piperazine
CID 138106389
4-[(4-methylpiperazin-1-yl)carbamoyl]benzoic acid
CID 83023034
1-(2-methylprop-2-enyl)-3-[[4-(naphthalen-2-yloxymethyl)benzoyl]amino]thiourea
CID 8625762
N-[(Z)-(2,4-dimethylphenyl)methylideneamino]-4-(naphthalen-2-yloxymethyl)benzamide
CID 7928974
2-[(6-phenylmethoxynaphthalene-2-carbonyl)amino]-3-(4-phenylphenyl)propanoic acid
CID 58677474
N-[2-[4-[1-(4-methylpiperazin-1-yl)ethyl]phenyl]ethyl]-4-phenylmethoxybenzamide
CID 23090894
4-(naphthalen-2-yloxymethyl)-N'-[2-(2-oxoquinoxalin-1-yl)acetyl]benzohydrazide
CID 26636107
N-[(E)-(3,4-difluorophenyl)methylideneamino]-4-(naphthalen-2-yloxymethyl)benzamide
CID 16553490

Frequently Asked Questions

What is the IUPAC name of N-(4-methylpiperazin-1-yl)-4-(naphthalen-2-yloxymethyl)benzamide?
The IUPAC name of N-(4-methylpiperazin-1-yl)-4-(naphthalen-2-yloxymethyl)benzamide (CID 19578268) is N-(4-methylpiperazin-1-yl)-4-(naphthalen-2-yloxymethyl)benzamide.
What is the SMILES notation for N-(4-methylpiperazin-1-yl)-4-(naphthalen-2-yloxymethyl)benzamide?
The canonical SMILES for N-(4-methylpiperazin-1-yl)-4-(naphthalen-2-yloxymethyl)benzamide is CN1CCN(NC(=O)c2ccc(COc3ccc4ccccc4c3)cc2)CC1.
What is the InChIKey of N-(4-methylpiperazin-1-yl)-4-(naphthalen-2-yloxymethyl)benzamide?
The InChIKey is AONCVIMWCXWJDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O2/c1-25-12-14-26(15-13-25)24-23(27)20-8-6-18(7-9-20)17-28-22-11-10-19-4-2-3-5-21(19)16-22/h2-11,16H,12-15,17H2,1H3,(H,24,27).
What are the key properties of N-(4-methylpiperazin-1-yl)-4-(naphthalen-2-yloxymethyl)benzamide?
N-(4-methylpiperazin-1-yl)-4-(naphthalen-2-yloxymethyl)benzamide has a molecular weight of 375.47 g/mol, XLogP of 3.31, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylpiperazin-1-yl)-4-(naphthalen-2-yloxymethyl)benzamide is sourced from PubChem (CID 19578268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).