1-(4-acetylpiperazin-1-yl)-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]ethanone

C18H32N4O3 — CID 60503697

IUPAC1-(4-acetylpiperazin-1-yl)-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]ethanone
SMILESCC(=O)N1CCN(C(=O)CN2CCC(CN3CCOCC3)CC2)CC1
InChIInChI=1S/C18H32N4O3/c1-16(23)21-6-8-22(9-7-21)18(24)15-19-4-2-17(3-5-19)14-20-10-12-25-13-11-20/h17H,2-15H2,1H3
InChIKeyGVWQAMOGIFIROQ-UHFFFAOYSA-N
MW352.48 g/mol
LogP-0.28
Rot. Bonds4

About 1-(4-acetylpiperazin-1-yl)-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]ethanone

1-(4-acetylpiperazin-1-yl)-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]ethanone (PubChem CID 60503697) has the molecular formula C18H32N4O3 and a molecular weight of 352.48 g/mol. Its IUPAC name is 1-(4-acetylpiperazin-1-yl)-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]ethanone.

Molecular Properties

Compound Name1-(4-acetylpiperazin-1-yl)-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]ethanone
PubChem CID60503697
Molecular FormulaC18H32N4O3
Molecular Weight352.48 g/mol
Exact Mass352.25
IUPAC Name1-(4-acetylpiperazin-1-yl)-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]ethanone
SMILESCC(=O)N1CCN(C(=O)CN2CCC(CN3CCOCC3)CC2)CC1
InChIInChI=1S/C18H32N4O3/c1-16(23)21-6-8-22(9-7-21)18(24)15-19-4-2-17(3-5-19)14-20-10-12-25-13-11-20/h17H,2-15H2,1H3
InChIKeyGVWQAMOGIFIROQ-UHFFFAOYSA-N
XLogP-0.28
TPSA56.33 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.48
LogP ≤ 5-0.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-(2,6-dimethylmorpholin-4-yl)-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]ethanone
CID 60503561
1-[4-(morpholin-4-ylmethyl)piperidin-1-yl]propan-1-one
CID 60773954
1-[3-(morpholin-4-ylmethyl)azetidin-1-yl]ethanone
CID 130138001
N-methyl-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]acetamide
CID 60503699
3-methyl-1-[4-(morpholin-4-ylmethyl)piperidin-1-yl]butan-1-one
CID 110284682
2-[4-(2-methylpropyl)piperidin-1-yl]-1-morpholin-4-ylethanone
CID 145317208
2-(4-aminopiperidin-1-yl)-1-morpholin-4-ylethanone;dihydrochloride
CID 56773516
3-chloro-1-[4-(morpholin-4-ylmethyl)piperidin-1-yl]propan-1-one
CID 54876000
N-cyclopropyl-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]acetamide
CID 60503463
2-(azepan-1-yl)-1-[3-(morpholin-4-ylmethyl)piperidin-1-yl]ethanone
CID 131914309
N-methyl-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]-N-phenylacetamide
CID 60503563
1-(4-acetylpiperazin-1-yl)-2-[4-(1-aminoethyl)piperidin-1-yl]ethanone
CID 63594840

Frequently Asked Questions

What is the IUPAC name of 1-(4-acetylpiperazin-1-yl)-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]ethanone?
The IUPAC name of 1-(4-acetylpiperazin-1-yl)-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]ethanone (CID 60503697) is 1-(4-acetylpiperazin-1-yl)-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]ethanone.
What is the SMILES notation for 1-(4-acetylpiperazin-1-yl)-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]ethanone?
The canonical SMILES for 1-(4-acetylpiperazin-1-yl)-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]ethanone is CC(=O)N1CCN(C(=O)CN2CCC(CN3CCOCC3)CC2)CC1.
What is the InChIKey of 1-(4-acetylpiperazin-1-yl)-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]ethanone?
The InChIKey is GVWQAMOGIFIROQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32N4O3/c1-16(23)21-6-8-22(9-7-21)18(24)15-19-4-2-17(3-5-19)14-20-10-12-25-13-11-20/h17H,2-15H2,1H3.
What are the key properties of 1-(4-acetylpiperazin-1-yl)-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]ethanone?
1-(4-acetylpiperazin-1-yl)-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]ethanone has a molecular weight of 352.48 g/mol, XLogP of -0.28, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-acetylpiperazin-1-yl)-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]ethanone is sourced from PubChem (CID 60503697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).