2-[4-(morpholine-2-carbonyl)piperazin-1-yl]-1-piperidin-1-ylethanone;dihydrochloride

C16H30Cl2N4O3 — CID 119837297

IUPAC2-[4-(morpholine-2-carbonyl)piperazin-1-yl]-1-piperidin-1-ylethanone;dihydrochloride
SMILESCl.Cl.O=C(CN1CCN(C(=O)C2CNCCO2)CC1)N1CCCCC1
InChIInChI=1S/C16H28N4O3.2ClH/c21-15(19-5-2-1-3-6-19)13-18-7-9-20(10-8-18)16(22)14-12-17-4-11-23-14;;/h14,17H,1-13H2;2*1H
InChIKeyXDLPMXPXGIJZDO-UHFFFAOYSA-N
MW397.35 g/mol
LogP-0.02
Rot. Bonds3

About 2-[4-(morpholine-2-carbonyl)piperazin-1-yl]-1-piperidin-1-ylethanone;dihydrochloride

2-[4-(morpholine-2-carbonyl)piperazin-1-yl]-1-piperidin-1-ylethanone;dihydrochloride (PubChem CID 119837297) has the molecular formula C16H30Cl2N4O3 and a molecular weight of 397.35 g/mol. Its IUPAC name is 2-[4-(morpholine-2-carbonyl)piperazin-1-yl]-1-piperidin-1-ylethanone;dihydrochloride.

Molecular Properties

Compound Name2-[4-(morpholine-2-carbonyl)piperazin-1-yl]-1-piperidin-1-ylethanone;dihydrochloride
PubChem CID119837297
Molecular FormulaC16H30Cl2N4O3
Molecular Weight397.35 g/mol
Exact Mass396.17
IUPAC Name2-[4-(morpholine-2-carbonyl)piperazin-1-yl]-1-piperidin-1-ylethanone;dihydrochloride
SMILESCl.Cl.O=C(CN1CCN(C(=O)C2CNCCO2)CC1)N1CCCCC1
InChIInChI=1S/C16H28N4O3.2ClH/c21-15(19-5-2-1-3-6-19)13-18-7-9-20(10-8-18)16(22)14-12-17-4-11-23-14;;/h14,17H,1-13H2;2*1H
InChIKeyXDLPMXPXGIJZDO-UHFFFAOYSA-N
XLogP-0.02
TPSA65.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.35
LogP ≤ 5-0.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-(morpholine-2-carbonyl)piperazin-1-yl]-1-morpholin-4-ylethanone
CID 119834280
morpholin-2-yl(piperidin-1-yl)methanone;hydrochloride
CID 71298615
1-(2-methylpiperidin-1-yl)-2-[4-(morpholine-2-carbonyl)piperazin-1-yl]ethanone
CID 119851432
1-piperidin-1-yl-2-[4-(pyrrolidine-3-carbonyl)piperazin-1-yl]ethanone;dihydrochloride
CID 119837309
morpholin-2-yl-(4-propyl-1,4-diazepan-1-yl)methanone
CID 131911390
morpholin-2-yl-(4-piperidin-1-ylpiperidin-1-yl)methanone;dihydrochloride
CID 119842984
[4-(2-methoxyethyl)piperazin-1-yl]-morpholin-2-ylmethanone;dihydrochloride
CID 119838568
2-[4-(piperidine-3-carbonyl)piperazin-1-yl]-1-pyrrolidin-1-ylethanone
CID 119833931
3-azaspiro[5.5]undecan-3-yl(morpholin-2-yl)methanone;hydrochloride
CID 119768999
1-morpholin-4-yl-2-[4-(pyrrolidine-3-carbonyl)piperazin-1-yl]ethanone;dihydrochloride
CID 119834289
morpholin-2-yl-[4-(oxolan-3-ylmethyl)piperazin-1-yl]methanone;dihydrochloride
CID 119897545
2-[4-(piperidine-3-carbonyl)-1,4-diazepan-1-yl]-1-pyrrolidin-1-ylethanone
CID 119844103

Frequently Asked Questions

What is the IUPAC name of 2-[4-(morpholine-2-carbonyl)piperazin-1-yl]-1-piperidin-1-ylethanone;dihydrochloride?
The IUPAC name of 2-[4-(morpholine-2-carbonyl)piperazin-1-yl]-1-piperidin-1-ylethanone;dihydrochloride (CID 119837297) is 2-[4-(morpholine-2-carbonyl)piperazin-1-yl]-1-piperidin-1-ylethanone;dihydrochloride.
What is the SMILES notation for 2-[4-(morpholine-2-carbonyl)piperazin-1-yl]-1-piperidin-1-ylethanone;dihydrochloride?
The canonical SMILES for 2-[4-(morpholine-2-carbonyl)piperazin-1-yl]-1-piperidin-1-ylethanone;dihydrochloride is Cl.Cl.O=C(CN1CCN(C(=O)C2CNCCO2)CC1)N1CCCCC1.
What is the InChIKey of 2-[4-(morpholine-2-carbonyl)piperazin-1-yl]-1-piperidin-1-ylethanone;dihydrochloride?
The InChIKey is XDLPMXPXGIJZDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N4O3.2ClH/c21-15(19-5-2-1-3-6-19)13-18-7-9-20(10-8-18)16(22)14-12-17-4-11-23-14;;/h14,17H,1-13H2;2*1H.
What are the key properties of 2-[4-(morpholine-2-carbonyl)piperazin-1-yl]-1-piperidin-1-ylethanone;dihydrochloride?
2-[4-(morpholine-2-carbonyl)piperazin-1-yl]-1-piperidin-1-ylethanone;dihydrochloride has a molecular weight of 397.35 g/mol, XLogP of -0.02, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(morpholine-2-carbonyl)piperazin-1-yl]-1-piperidin-1-ylethanone;dihydrochloride is sourced from PubChem (CID 119837297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).