2-[4-(furan-2-carbonyl)piperazin-1-yl]-N-[(1S)-1-naphthalen-1-ylethyl]acetamide

C23H25N3O3 — CID 8549558

IUPAC2-[4-(furan-2-carbonyl)piperazin-1-yl]-N-[(1S)-1-naphthalen-1-ylethyl]acetamide
SMILESC[C@H](NC(=O)CN1CCN(C(=O)c2ccco2)CC1)c1cccc2ccccc12
InChIInChI=1S/C23H25N3O3/c1-17(19-9-4-7-18-6-2-3-8-20(18)19)24-22(27)16-25-11-13-26(14-12-25)23(28)21-10-5-15-29-21/h2-10,15,17H,11-14,16H2,1H3,(H,24,27)/t17-/m0/s1
InChIKeyLLMZJNUMODBFQT-KRWDZBQOSA-N
MW391.47 g/mol
LogP3.07
Rot. Bonds5

About 2-[4-(furan-2-carbonyl)piperazin-1-yl]-N-[(1S)-1-naphthalen-1-ylethyl]acetamide

2-[4-(furan-2-carbonyl)piperazin-1-yl]-N-[(1S)-1-naphthalen-1-ylethyl]acetamide (PubChem CID 8549558) has the molecular formula C23H25N3O3 and a molecular weight of 391.47 g/mol. Its IUPAC name is 2-[4-(furan-2-carbonyl)piperazin-1-yl]-N-[(1S)-1-naphthalen-1-ylethyl]acetamide.

Molecular Properties

Compound Name2-[4-(furan-2-carbonyl)piperazin-1-yl]-N-[(1S)-1-naphthalen-1-ylethyl]acetamide
PubChem CID8549558
Molecular FormulaC23H25N3O3
Molecular Weight391.47 g/mol
Exact Mass391.19
IUPAC Name2-[4-(furan-2-carbonyl)piperazin-1-yl]-N-[(1S)-1-naphthalen-1-ylethyl]acetamide
SMILESC[C@H](NC(=O)CN1CCN(C(=O)c2ccco2)CC1)c1cccc2ccccc12
InChIInChI=1S/C23H25N3O3/c1-17(19-9-4-7-18-6-2-3-8-20(18)19)24-22(27)16-25-11-13-26(14-12-25)23(28)21-10-5-15-29-21/h2-10,15,17H,11-14,16H2,1H3,(H,24,27)/t17-/m0/s1
InChIKeyLLMZJNUMODBFQT-KRWDZBQOSA-N
XLogP3.07
TPSA65.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.47
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[4-(furan-2-carbonyl)piperazin-1-yl]-N-[(1S)-1-naphthalen-1-ylethyl]acetamide with MolForge

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Related Compounds

N-[1-(4-fluorophenyl)ethyl]-2-[4-(furan-2-carbonyl)piperazin-1-yl]acetamide
CID 51170789
N-tert-butyl-2-[4-(furan-2-carbonyl)piperazin-1-yl]acetamide
CID 26495641
2-[4-(3-chlorobenzoyl)-1,4-diazepan-1-yl]-N-(1-naphthalen-1-ylethyl)acetamide
CID 60585100
N'-acetyl-2-[4-(furan-2-carbonyl)piperazin-1-yl]acetohydrazide
CID 8548952
(4aS,8aR)-4-(furan-2-carbonyl)-N-(1-naphthalen-1-ylethyl)-2,3,4a,5,6,7,8,8a-octahydroquinoxaline-1-carboxamide
CID 10765144
2-[4-(furan-2-carbonyl)piperazin-1-yl]-N-[(4-methoxyphenyl)methyl]acetamide
CID 37375142
2-[4-(furan-2-carbonyl)piperazin-1-yl]-N-phenylacetamide
CID 773151
2-[4-(azepane-1-carbonyl)piperidin-1-yl]-N-[(1R)-1-naphthalen-1-ylethyl]acetamide
CID 41104934
N-(2-methoxyethyl)-2-[4-[2-(1-naphthalen-1-ylethylamino)-2-oxoethyl]piperazin-1-yl]acetamide
CID 24507241
N-(2-chlorophenyl)-2-[4-[2-[[(1S)-1-naphthalen-1-ylethyl]amino]-2-oxoethyl]piperazin-1-yl]acetamide
CID 30625656
furan-2-yl-[4-(2-methylpropyl)piperazin-1-yl]methanone
CID 21026314
2-[[(1R)-1-(furan-2-yl)ethyl]amino]-N-[(1S)-1-naphthalen-1-ylethyl]acetamide
CID 8922326

Frequently Asked Questions

What is the IUPAC name of 2-[4-(furan-2-carbonyl)piperazin-1-yl]-N-[(1S)-1-naphthalen-1-ylethyl]acetamide?
The IUPAC name of 2-[4-(furan-2-carbonyl)piperazin-1-yl]-N-[(1S)-1-naphthalen-1-ylethyl]acetamide (CID 8549558) is 2-[4-(furan-2-carbonyl)piperazin-1-yl]-N-[(1S)-1-naphthalen-1-ylethyl]acetamide.
What is the SMILES notation for 2-[4-(furan-2-carbonyl)piperazin-1-yl]-N-[(1S)-1-naphthalen-1-ylethyl]acetamide?
The canonical SMILES for 2-[4-(furan-2-carbonyl)piperazin-1-yl]-N-[(1S)-1-naphthalen-1-ylethyl]acetamide is C[C@H](NC(=O)CN1CCN(C(=O)c2ccco2)CC1)c1cccc2ccccc12.
What is the InChIKey of 2-[4-(furan-2-carbonyl)piperazin-1-yl]-N-[(1S)-1-naphthalen-1-ylethyl]acetamide?
The InChIKey is LLMZJNUMODBFQT-KRWDZBQOSA-N. The full InChI is InChI=1S/C23H25N3O3/c1-17(19-9-4-7-18-6-2-3-8-20(18)19)24-22(27)16-25-11-13-26(14-12-25)23(28)21-10-5-15-29-21/h2-10,15,17H,11-14,16H2,1H3,(H,24,27)/t17-/m0/s1.
What are the key properties of 2-[4-(furan-2-carbonyl)piperazin-1-yl]-N-[(1S)-1-naphthalen-1-ylethyl]acetamide?
2-[4-(furan-2-carbonyl)piperazin-1-yl]-N-[(1S)-1-naphthalen-1-ylethyl]acetamide has a molecular weight of 391.47 g/mol, XLogP of 3.07, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(furan-2-carbonyl)piperazin-1-yl]-N-[(1S)-1-naphthalen-1-ylethyl]acetamide is sourced from PubChem (CID 8549558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).