N-benzyl-4-(2-morpholin-4-ylacetyl)piperazine-1-carboxamide

C18H26N4O3 — CID 24664690

IUPACN-benzyl-4-(2-morpholin-4-ylacetyl)piperazine-1-carboxamide
SMILESO=C(CN1CCOCC1)N1CCN(C(=O)NCc2ccccc2)CC1
InChIInChI=1S/C18H26N4O3/c23-17(15-20-10-12-25-13-11-20)21-6-8-22(9-7-21)18(24)19-14-16-4-2-1-3-5-16/h1-5H,6-15H2,(H,19,24)
InChIKeyVWLWDFLCHIBJAR-UHFFFAOYSA-N
MW346.43 g/mol
LogP0.37
Rot. Bonds4

About N-benzyl-4-(2-morpholin-4-ylacetyl)piperazine-1-carboxamide

N-benzyl-4-(2-morpholin-4-ylacetyl)piperazine-1-carboxamide (PubChem CID 24664690) has the molecular formula C18H26N4O3 and a molecular weight of 346.43 g/mol. Its IUPAC name is N-benzyl-4-(2-morpholin-4-ylacetyl)piperazine-1-carboxamide.

Molecular Properties

Compound NameN-benzyl-4-(2-morpholin-4-ylacetyl)piperazine-1-carboxamide
PubChem CID24664690
Molecular FormulaC18H26N4O3
Molecular Weight346.43 g/mol
Exact Mass346.20
IUPAC NameN-benzyl-4-(2-morpholin-4-ylacetyl)piperazine-1-carboxamide
SMILESO=C(CN1CCOCC1)N1CCN(C(=O)NCc2ccccc2)CC1
InChIInChI=1S/C18H26N4O3/c23-17(15-20-10-12-25-13-11-20)21-6-8-22(9-7-21)18(24)19-14-16-4-2-1-3-5-16/h1-5H,6-15H2,(H,19,24)
InChIKeyVWLWDFLCHIBJAR-UHFFFAOYSA-N
XLogP0.37
TPSA65.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.43
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-benzyl-N-[(4-morpholin-4-ylphenyl)methyl]piperazine-1-carboxamide
CID 60570095
N-[[3-[(morpholine-4-carbonylamino)methyl]phenyl]methyl]morpholine-4-carboxamide
CID 118585548
2-[4-(2-morpholin-4-yl-2-oxoethyl)piperazin-1-yl]-N-(2-phenylethyl)acetamide
CID 30653596
N-benzylazonane-1-carboxamide
CID 130689649
N,4-dibenzylpiperazine-1-carboxamide;ethane
CID 91343107
N-[2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]-2-oxoethyl]-2-naphthalen-1-ylacetamide
CID 55495315
N-benzyl-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]acetamide
CID 30636341
1-morpholin-4-yl-2-[4-(3-phenylpropyl)piperazin-1-yl]ethanone
CID 47014088
N-benzyl-4-butanoyl-1,4-diazepane-1-carboxamide
CID 110811324
N-benzyl-4-[2-(1-methylpyrrol-3-yl)acetyl]piperazine-1-carboxamide
CID 110813034
2-(benzylamino)-1-morpholin-4-ylethanone
CID 23252432
N-benzyl-4-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl]piperazine-1-carboxamide
CID 110368764

Frequently Asked Questions

What is the IUPAC name of N-benzyl-4-(2-morpholin-4-ylacetyl)piperazine-1-carboxamide?
The IUPAC name of N-benzyl-4-(2-morpholin-4-ylacetyl)piperazine-1-carboxamide (CID 24664690) is N-benzyl-4-(2-morpholin-4-ylacetyl)piperazine-1-carboxamide.
What is the SMILES notation for N-benzyl-4-(2-morpholin-4-ylacetyl)piperazine-1-carboxamide?
The canonical SMILES for N-benzyl-4-(2-morpholin-4-ylacetyl)piperazine-1-carboxamide is O=C(CN1CCOCC1)N1CCN(C(=O)NCc2ccccc2)CC1.
What is the InChIKey of N-benzyl-4-(2-morpholin-4-ylacetyl)piperazine-1-carboxamide?
The InChIKey is VWLWDFLCHIBJAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4O3/c23-17(15-20-10-12-25-13-11-20)21-6-8-22(9-7-21)18(24)19-14-16-4-2-1-3-5-16/h1-5H,6-15H2,(H,19,24).
What are the key properties of N-benzyl-4-(2-morpholin-4-ylacetyl)piperazine-1-carboxamide?
N-benzyl-4-(2-morpholin-4-ylacetyl)piperazine-1-carboxamide has a molecular weight of 346.43 g/mol, XLogP of 0.37, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-4-(2-morpholin-4-ylacetyl)piperazine-1-carboxamide is sourced from PubChem (CID 24664690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).