N-(2-acetylphenyl)-2-[4-(naphthalene-1-carbonyl)piperazin-1-yl]acetamide

C25H25N3O3 — CID 35252913

IUPACN-(2-acetylphenyl)-2-[4-(naphthalene-1-carbonyl)piperazin-1-yl]acetamide
SMILESCC(=O)c1ccccc1NC(=O)CN1CCN(C(=O)c2cccc3ccccc23)CC1
InChIInChI=1S/C25H25N3O3/c1-18(29)20-9-4-5-12-23(20)26-24(30)17-27-13-15-28(16-14-27)25(31)22-11-6-8-19-7-2-3-10-21(19)22/h2-12H,13-17H2,1H3,(H,26,30)
InChIKeyBVMBDEDZLGSGFG-UHFFFAOYSA-N
MW415.49 g/mol
LogP3.44
Rot. Bonds5

About N-(2-acetylphenyl)-2-[4-(naphthalene-1-carbonyl)piperazin-1-yl]acetamide

N-(2-acetylphenyl)-2-[4-(naphthalene-1-carbonyl)piperazin-1-yl]acetamide (PubChem CID 35252913) has the molecular formula C25H25N3O3 and a molecular weight of 415.49 g/mol. Its IUPAC name is N-(2-acetylphenyl)-2-[4-(naphthalene-1-carbonyl)piperazin-1-yl]acetamide.

Molecular Properties

Compound NameN-(2-acetylphenyl)-2-[4-(naphthalene-1-carbonyl)piperazin-1-yl]acetamide
PubChem CID35252913
Molecular FormulaC25H25N3O3
Molecular Weight415.49 g/mol
Exact Mass415.19
IUPAC NameN-(2-acetylphenyl)-2-[4-(naphthalene-1-carbonyl)piperazin-1-yl]acetamide
SMILESCC(=O)c1ccccc1NC(=O)CN1CCN(C(=O)c2cccc3ccccc23)CC1
InChIInChI=1S/C25H25N3O3/c1-18(29)20-9-4-5-12-23(20)26-24(30)17-27-13-15-28(16-14-27)25(31)22-11-6-8-19-7-2-3-10-21(19)22/h2-12H,13-17H2,1H3,(H,26,30)
InChIKeyBVMBDEDZLGSGFG-UHFFFAOYSA-N
XLogP3.44
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.49
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-acetylphenyl)-2-[4-(4-propan-2-ylbenzoyl)piperazin-1-yl]acetamide
CID 35207173
N-(2-acetylphenyl)-2-(4-benzylpiperazin-1-yl)acetamide
CID 8902773
2-[4-(naphthalene-1-carbonyl)piperazin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
CID 35253095
N-(2-acetylphenyl)-2-[4-(2,2-difluoroethyl)-1,4-diazepan-1-yl]acetamide
CID 122138586
2-[4-(4-chlorobenzoyl)piperazin-1-yl]-N-naphthalen-1-ylacetamide
CID 55553446
2-[4-(2-fluorobenzoyl)piperazin-1-yl]-N-(2-fluorophenyl)acetamide
CID 15999180
N-(2-acetylphenyl)-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide
CID 8592653
N-(2-acetylphenyl)-2-(3,4-dihydroxypyrrolidin-1-yl)acetamide
CID 106672145
N-methyl-2-[4-(naphthalene-1-carbonyl)piperazin-1-yl]-N-phenylacetamide
CID 35251820
1-[2-(2-acetylanilino)-2-oxoethyl]piperidine-4-carboxylic acid;hydrochloride
CID 119906608
[4-(2-methylpropyl)piperazin-1-yl]-naphthalen-1-ylmethanone
CID 70229346
2-[[2-[4-(4-fluorobenzoyl)piperazin-1-yl]acetyl]amino]-N-(4-fluorophenyl)benzamide
CID 36876914

Frequently Asked Questions

What is the IUPAC name of N-(2-acetylphenyl)-2-[4-(naphthalene-1-carbonyl)piperazin-1-yl]acetamide?
The IUPAC name of N-(2-acetylphenyl)-2-[4-(naphthalene-1-carbonyl)piperazin-1-yl]acetamide (CID 35252913) is N-(2-acetylphenyl)-2-[4-(naphthalene-1-carbonyl)piperazin-1-yl]acetamide.
What is the SMILES notation for N-(2-acetylphenyl)-2-[4-(naphthalene-1-carbonyl)piperazin-1-yl]acetamide?
The canonical SMILES for N-(2-acetylphenyl)-2-[4-(naphthalene-1-carbonyl)piperazin-1-yl]acetamide is CC(=O)c1ccccc1NC(=O)CN1CCN(C(=O)c2cccc3ccccc23)CC1.
What is the InChIKey of N-(2-acetylphenyl)-2-[4-(naphthalene-1-carbonyl)piperazin-1-yl]acetamide?
The InChIKey is BVMBDEDZLGSGFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25N3O3/c1-18(29)20-9-4-5-12-23(20)26-24(30)17-27-13-15-28(16-14-27)25(31)22-11-6-8-19-7-2-3-10-21(19)22/h2-12H,13-17H2,1H3,(H,26,30).
What are the key properties of N-(2-acetylphenyl)-2-[4-(naphthalene-1-carbonyl)piperazin-1-yl]acetamide?
N-(2-acetylphenyl)-2-[4-(naphthalene-1-carbonyl)piperazin-1-yl]acetamide has a molecular weight of 415.49 g/mol, XLogP of 3.44, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-acetylphenyl)-2-[4-(naphthalene-1-carbonyl)piperazin-1-yl]acetamide is sourced from PubChem (CID 35252913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).