1-morpholin-4-ylethanone;bis(1-piperidin-1-ylethanone)

C20H37N3O4 — CID 157357806

IUPAC1-morpholin-4-ylethanone;bis(1-piperidin-1-ylethanone)
SMILESCC(=O)N1CCCCC1.CC(=O)N1CCCCC1.CC(=O)N1CCOCC1
InChIInChI=1S/2C7H13NO.C6H11NO2/c2*1-7(9)8-5-3-2-4-6-8;1-6(8)7-2-4-9-5-3-7/h2*2-6H2,1H3;2-5H2,1H3
InChIKeyBIHHGWNUPPZHID-UHFFFAOYSA-N
MW383.53 g/mol
LogP1.90
Rot. Bonds

About 1-morpholin-4-ylethanone;bis(1-piperidin-1-ylethanone)

1-morpholin-4-ylethanone;bis(1-piperidin-1-ylethanone) (PubChem CID 157357806) has the molecular formula C20H37N3O4 and a molecular weight of 383.53 g/mol. Its IUPAC name is 1-morpholin-4-ylethanone;bis(1-piperidin-1-ylethanone).

Molecular Properties

Compound Name1-morpholin-4-ylethanone;bis(1-piperidin-1-ylethanone)
PubChem CID157357806
Molecular FormulaC20H37N3O4
Molecular Weight383.53 g/mol
Exact Mass383.28
IUPAC Name1-morpholin-4-ylethanone;bis(1-piperidin-1-ylethanone)
SMILESCC(=O)N1CCCCC1.CC(=O)N1CCCCC1.CC(=O)N1CCOCC1
InChIInChI=1S/2C7H13NO.C6H11NO2/c2*1-7(9)8-5-3-2-4-6-8;1-6(8)7-2-4-9-5-3-7/h2*2-6H2,1H3;2-5H2,1H3
InChIKeyBIHHGWNUPPZHID-UHFFFAOYSA-N
XLogP1.90
TPSA70.16 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.53
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-morpholin-4-ylethanone;bis(1-piperidin-1-ylethanone)?
The IUPAC name of 1-morpholin-4-ylethanone;bis(1-piperidin-1-ylethanone) (CID 157357806) is 1-morpholin-4-ylethanone;bis(1-piperidin-1-ylethanone).
What is the SMILES notation for 1-morpholin-4-ylethanone;bis(1-piperidin-1-ylethanone)?
The canonical SMILES for 1-morpholin-4-ylethanone;bis(1-piperidin-1-ylethanone) is CC(=O)N1CCCCC1.CC(=O)N1CCCCC1.CC(=O)N1CCOCC1.
What is the InChIKey of 1-morpholin-4-ylethanone;bis(1-piperidin-1-ylethanone)?
The InChIKey is BIHHGWNUPPZHID-UHFFFAOYSA-N. The full InChI is InChI=1S/2C7H13NO.C6H11NO2/c2*1-7(9)8-5-3-2-4-6-8;1-6(8)7-2-4-9-5-3-7/h2*2-6H2,1H3;2-5H2,1H3.
What are the key properties of 1-morpholin-4-ylethanone;bis(1-piperidin-1-ylethanone)?
1-morpholin-4-ylethanone;bis(1-piperidin-1-ylethanone) has a molecular weight of 383.53 g/mol, XLogP of 1.90, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-morpholin-4-ylethanone;bis(1-piperidin-1-ylethanone) is sourced from PubChem (CID 157357806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).