N-(3-chlorophenyl)-2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]acetamide

C23H24ClN3O — CID 22195134

IUPACN-(3-chlorophenyl)-2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]acetamide
SMILESO=C(CN1CCN(Cc2cccc3ccccc23)CC1)Nc1cccc(Cl)c1
InChIInChI=1S/C23H24ClN3O/c24-20-8-4-9-21(15-20)25-23(28)17-27-13-11-26(12-14-27)16-19-7-3-6-18-5-1-2-10-22(18)19/h1-10,15H,11-14,16-17H2,(H,25,28)
InChIKeyKVUHBWFOVDYOIM-UHFFFAOYSA-N
MW393.92 g/mol
LogP4.25
Rot. Bonds5

About N-(3-chlorophenyl)-2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]acetamide

N-(3-chlorophenyl)-2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]acetamide (PubChem CID 22195134) has the molecular formula C23H24ClN3O and a molecular weight of 393.92 g/mol. Its IUPAC name is N-(3-chlorophenyl)-2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]acetamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]acetamide
PubChem CID22195134
Molecular FormulaC23H24ClN3O
Molecular Weight393.92 g/mol
Exact Mass393.16
IUPAC NameN-(3-chlorophenyl)-2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]acetamide
SMILESO=C(CN1CCN(Cc2cccc3ccccc23)CC1)Nc1cccc(Cl)c1
InChIInChI=1S/C23H24ClN3O/c24-20-8-4-9-21(15-20)25-23(28)17-27-13-11-26(12-14-27)16-19-7-3-6-18-5-1-2-10-22(18)19/h1-10,15H,11-14,16-17H2,(H,25,28)
InChIKeyKVUHBWFOVDYOIM-UHFFFAOYSA-N
XLogP4.25
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.92
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-chlorophenyl)-2-(4-formylpiperazin-1-yl)acetamide
CID 108995802
N-(3-chlorophenyl)-2-pyrrolidin-1-ylacetamide;hydrochloride
CID 2917131
N-(3-chlorophenyl)-2-[4-(thiophen-3-ylmethyl)piperazin-1-yl]acetamide
CID 17491999
2-[4-[2-(azepan-1-yl)-2-oxoethyl]piperazin-1-yl]-N-(3-chlorophenyl)acetamide
CID 34905366
1-[(3-chlorophenyl)methyl]-4-(naphthalen-1-ylmethyl)piperazine
CID 7026318
2-[4-(3-chlorophenyl)piperazin-1-yl]-N-phenylacetamide
CID 6467969
N-(3-acetylphenyl)-2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]acetamide
CID 9258558
N-(3-chlorophenyl)-4-(1H-indol-3-ylmethyl)piperazine-1-carboxamide
CID 110397486
2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-N-(3-cyanophenyl)acetamide
CID 55362309
1,4-bis(naphthalen-1-ylmethyl)piperazine
CID 4846171
N-(3-chlorophenyl)-2-[4-methyl-4-(methylamino)piperidin-1-yl]acetamide
CID 115304932
N-cyclohexyl-2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]acetamide
CID 9046933

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]acetamide?
The IUPAC name of N-(3-chlorophenyl)-2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]acetamide (CID 22195134) is N-(3-chlorophenyl)-2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]acetamide.
What is the SMILES notation for N-(3-chlorophenyl)-2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]acetamide?
The canonical SMILES for N-(3-chlorophenyl)-2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]acetamide is O=C(CN1CCN(Cc2cccc3ccccc23)CC1)Nc1cccc(Cl)c1.
What is the InChIKey of N-(3-chlorophenyl)-2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]acetamide?
The InChIKey is KVUHBWFOVDYOIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24ClN3O/c24-20-8-4-9-21(15-20)25-23(28)17-27-13-11-26(12-14-27)16-19-7-3-6-18-5-1-2-10-22(18)19/h1-10,15H,11-14,16-17H2,(H,25,28).
What are the key properties of N-(3-chlorophenyl)-2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]acetamide?
N-(3-chlorophenyl)-2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]acetamide has a molecular weight of 393.92 g/mol, XLogP of 4.25, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]acetamide is sourced from PubChem (CID 22195134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).