2-[4-(naphthalene-1-carbonyl)piperazin-1-yl]-2-phenylacetamide

C23H23N3O2 — CID 46568132

IUPAC2-[4-(naphthalene-1-carbonyl)piperazin-1-yl]-2-phenylacetamide
SMILESNC(=O)C(c1ccccc1)N1CCN(C(=O)c2cccc3ccccc23)CC1
InChIInChI=1S/C23H23N3O2/c24-22(27)21(18-8-2-1-3-9-18)25-13-15-26(16-14-25)23(28)20-12-6-10-17-7-4-5-11-19(17)20/h1-12,21H,13-16H2,(H2,24,27)
InChIKeyMMRXQDHLRCAWGV-UHFFFAOYSA-N
MW373.46 g/mol
LogP2.82
Rot. Bonds4

About 2-[4-(naphthalene-1-carbonyl)piperazin-1-yl]-2-phenylacetamide

2-[4-(naphthalene-1-carbonyl)piperazin-1-yl]-2-phenylacetamide (PubChem CID 46568132) has the molecular formula C23H23N3O2 and a molecular weight of 373.46 g/mol. Its IUPAC name is 2-[4-(naphthalene-1-carbonyl)piperazin-1-yl]-2-phenylacetamide.

Molecular Properties

Compound Name2-[4-(naphthalene-1-carbonyl)piperazin-1-yl]-2-phenylacetamide
PubChem CID46568132
Molecular FormulaC23H23N3O2
Molecular Weight373.46 g/mol
Exact Mass373.18
IUPAC Name2-[4-(naphthalene-1-carbonyl)piperazin-1-yl]-2-phenylacetamide
SMILESNC(=O)C(c1ccccc1)N1CCN(C(=O)c2cccc3ccccc23)CC1
InChIInChI=1S/C23H23N3O2/c24-22(27)21(18-8-2-1-3-9-18)25-13-15-26(16-14-25)23(28)20-12-6-10-17-7-4-5-11-19(17)20/h1-12,21H,13-16H2,(H2,24,27)
InChIKeyMMRXQDHLRCAWGV-UHFFFAOYSA-N
XLogP2.82
TPSA66.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.46
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 2-(4-chlorophenyl)-2-[4-(naphthalene-1-carbonyl)piperazin-1-yl]acetate
CID 46431394
(4R)-4-[4-(naphthalene-1-carbonyl)piperazin-1-yl]-4-phenylbutanoic acid
CID 124604342
[4-(naphthalene-1-carbonyl)piperazin-1-yl]-phenylmethanone
CID 1074720
(2R)-2-(4-acetylpiperazin-1-yl)-2-phenylacetamide
CID 51908871
2-[4-[1-(naphthalene-1-carbonyl)piperidine-4-carbonyl]piperazin-1-yl]propanamide
CID 86955156
2-[4-(4-ethylbenzoyl)piperazin-1-yl]-2-phenylacetamide
CID 51297445
[4-(naphthalene-1-carbonyl)piperazin-1-yl]-(4-phenylphenyl)methanone
CID 2169062
[4-(naphthalene-1-carbonyl)piperazin-1-yl]-(4-propan-2-ylphenyl)methanone
CID 108569250
(2R)-2-[4-(furan-3-carbonyl)piperazin-1-yl]-2-phenylacetamide
CID 34955258
2-chloro-1-[4-(naphthalene-1-carbonyl)piperazin-1-yl]ethanone
CID 108569251
[4-(2-methylpropyl)piperazin-1-yl]-naphthalen-1-ylmethanone
CID 70229346
naphthalen-1-yl-[4-(6-piperidin-1-ylpyridazin-3-yl)piperazin-1-yl]methanone
CID 121053800

Frequently Asked Questions

What is the IUPAC name of 2-[4-(naphthalene-1-carbonyl)piperazin-1-yl]-2-phenylacetamide?
The IUPAC name of 2-[4-(naphthalene-1-carbonyl)piperazin-1-yl]-2-phenylacetamide (CID 46568132) is 2-[4-(naphthalene-1-carbonyl)piperazin-1-yl]-2-phenylacetamide.
What is the SMILES notation for 2-[4-(naphthalene-1-carbonyl)piperazin-1-yl]-2-phenylacetamide?
The canonical SMILES for 2-[4-(naphthalene-1-carbonyl)piperazin-1-yl]-2-phenylacetamide is NC(=O)C(c1ccccc1)N1CCN(C(=O)c2cccc3ccccc23)CC1.
What is the InChIKey of 2-[4-(naphthalene-1-carbonyl)piperazin-1-yl]-2-phenylacetamide?
The InChIKey is MMRXQDHLRCAWGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O2/c24-22(27)21(18-8-2-1-3-9-18)25-13-15-26(16-14-25)23(28)20-12-6-10-17-7-4-5-11-19(17)20/h1-12,21H,13-16H2,(H2,24,27).
What are the key properties of 2-[4-(naphthalene-1-carbonyl)piperazin-1-yl]-2-phenylacetamide?
2-[4-(naphthalene-1-carbonyl)piperazin-1-yl]-2-phenylacetamide has a molecular weight of 373.46 g/mol, XLogP of 2.82, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(naphthalene-1-carbonyl)piperazin-1-yl]-2-phenylacetamide is sourced from PubChem (CID 46568132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).