morpholin-4-yl-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]methanone

C20H25N3O2 — CID 31695814

IUPACmorpholin-4-yl-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]methanone
SMILESO=C(N1CCOCC1)N1CCN(Cc2cccc3ccccc23)CC1
InChIInChI=1S/C20H25N3O2/c24-20(23-12-14-25-15-13-23)22-10-8-21(9-11-22)16-18-6-3-5-17-4-1-2-7-19(17)18/h1-7H,8-16H2
InChIKeyPHOXPDZLFXXNDF-UHFFFAOYSA-N
MW339.44 g/mol
LogP2.41
Rot. Bonds2

About morpholin-4-yl-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]methanone

morpholin-4-yl-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]methanone (PubChem CID 31695814) has the molecular formula C20H25N3O2 and a molecular weight of 339.44 g/mol. Its IUPAC name is morpholin-4-yl-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]methanone.

Molecular Properties

Compound Namemorpholin-4-yl-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]methanone
PubChem CID31695814
Molecular FormulaC20H25N3O2
Molecular Weight339.44 g/mol
Exact Mass339.19
IUPAC Namemorpholin-4-yl-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]methanone
SMILESO=C(N1CCOCC1)N1CCN(Cc2cccc3ccccc23)CC1
InChIInChI=1S/C20H25N3O2/c24-20(23-12-14-25-15-13-23)22-10-8-21(9-11-22)16-18-6-3-5-17-4-1-2-7-19(17)18/h1-7H,8-16H2
InChIKeyPHOXPDZLFXXNDF-UHFFFAOYSA-N
XLogP2.41
TPSA36.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 52.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-morpholin-4-ylmethanone
CID 51074617
[4-[(2-hydroxynaphthalen-1-yl)methyl]piperazin-1-yl]-morpholin-4-ylmethanone
CID 26026735
1,4-bis(naphthalen-1-ylmethyl)piperazine
CID 4846171
1-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]butan-1-one
CID 60601295
N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-3-naphthalen-1-ylpropanamide
CID 53278818
(2R)-2-amino-1-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]propan-1-one
CID 119834679
(3,5-difluorophenyl)-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]methanone
CID 9397599
1-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]-4-phenylbutane-1,4-dione
CID 9397565
1-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]-3,3-diphenylpropan-1-one
CID 67588371
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(naphthalen-1-ylmethyl)piperazine-1-carboxamide
CID 17349195
1-[4-[4-(naphthalen-1-ylmethyl)piperazine-1-carbonyl]piperidin-1-yl]ethanone
CID 9397930
(2,6-dimethoxyphenyl)-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]methanone
CID 1112837

Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]methanone?
The IUPAC name of morpholin-4-yl-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]methanone (CID 31695814) is morpholin-4-yl-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]methanone.
What is the SMILES notation for morpholin-4-yl-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]methanone?
The canonical SMILES for morpholin-4-yl-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]methanone is O=C(N1CCOCC1)N1CCN(Cc2cccc3ccccc23)CC1.
What is the InChIKey of morpholin-4-yl-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]methanone?
The InChIKey is PHOXPDZLFXXNDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O2/c24-20(23-12-14-25-15-13-23)22-10-8-21(9-11-22)16-18-6-3-5-17-4-1-2-7-19(17)18/h1-7H,8-16H2.
What are the key properties of morpholin-4-yl-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]methanone?
morpholin-4-yl-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]methanone has a molecular weight of 339.44 g/mol, XLogP of 2.41, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]methanone is sourced from PubChem (CID 31695814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).