ethane;4-methylmorpholine;1-methylpiperazine;1-methylpiperidine

C22H54N4O — CID 145109143

IUPACethane;4-methylmorpholine;1-methylpiperazine;1-methylpiperidine
SMILESCC.CC.CC.CN1CCCCC1.CN1CCNCC1.CN1CCOCC1
InChIInChI=1S/C6H13N.C5H12N2.C5H11NO.3C2H6/c1-7-5-3-2-4-6-7;1-7-4-2-6-3-5-7;1-6-2-4-7-5-3-6;3*1-2/h2-6H2,1H3;6H,2-5H2,1H3;2-5H2,1H3;3*1-2H3
InChIKeyZJLSLDRYNJRBEJ-UHFFFAOYSA-N
MW390.70 g/mol
LogP3.65
Rot. Bonds

About ethane;4-methylmorpholine;1-methylpiperazine;1-methylpiperidine

ethane;4-methylmorpholine;1-methylpiperazine;1-methylpiperidine (PubChem CID 145109143) has the molecular formula C22H54N4O and a molecular weight of 390.70 g/mol. Its IUPAC name is ethane;4-methylmorpholine;1-methylpiperazine;1-methylpiperidine.

Molecular Properties

Compound Nameethane;4-methylmorpholine;1-methylpiperazine;1-methylpiperidine
PubChem CID145109143
Molecular FormulaC22H54N4O
Molecular Weight390.70 g/mol
Exact Mass390.43
IUPAC Nameethane;4-methylmorpholine;1-methylpiperazine;1-methylpiperidine
SMILESCC.CC.CC.CN1CCCCC1.CN1CCNCC1.CN1CCOCC1
InChIInChI=1S/C6H13N.C5H12N2.C5H11NO.3C2H6/c1-7-5-3-2-4-6-7;1-7-4-2-6-3-5-7;1-6-2-4-7-5-3-6;3*1-2/h2-6H2,1H3;6H,2-5H2,1H3;2-5H2,1H3;3*1-2H3
InChIKeyZJLSLDRYNJRBEJ-UHFFFAOYSA-N
XLogP3.65
TPSA30.98 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.70
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[1-(3,9-Diazaspiro[5.5]undecan-3-yl)-2-methylpropan-2-yl]morpholine
CID 56894471
5-Fluoro-4-(4-morpholin-4-ylpiperidin-1-yl)piperidin-3-amine
CID 124022758
5-Fluoro-4-(4-morpholin-4-ylpiperidin-1-yl)-1-pentylpiperidin-3-amine
CID 156302535
N-[2-(2-piperidinoethylamino)ethyl]morpholine
CID 60686910
Propylpiperazinyl-ethyl ether
CID 129817227
N-ethyl-N-(2-morpholin-4-ylethyl)piperidin-3-amine
CID 56711148
4-(2-Piperazin-1-ylpiperidin-2-yl)morpholine
CID 22460873
4-(3-Piperidin-1-yl-3-pyrrolidin-1-ylpiperazin-2-yl)morpholine
CID 53663701
2-morpholin-4-yl-N-(3-morpholin-4-ylpropylamino)-N-(3-piperidin-1-ylpropylamino)ethanamine
CID 53915014
N-(2-morpholin-4-ylethylamino)-3-piperidin-1-yl-N-(2-piperidin-1-ylethylamino)propan-1-amine
CID 53948904
4-(2-Piperidin-1-ylpiperazin-2-yl)morpholine
CID 54005229
2-Piperidin-1-ylmorpholine
CID 54378278

Frequently Asked Questions

What is the IUPAC name of ethane;4-methylmorpholine;1-methylpiperazine;1-methylpiperidine?
The IUPAC name of ethane;4-methylmorpholine;1-methylpiperazine;1-methylpiperidine (CID 145109143) is ethane;4-methylmorpholine;1-methylpiperazine;1-methylpiperidine.
What is the SMILES notation for ethane;4-methylmorpholine;1-methylpiperazine;1-methylpiperidine?
The canonical SMILES for ethane;4-methylmorpholine;1-methylpiperazine;1-methylpiperidine is CC.CC.CC.CN1CCCCC1.CN1CCNCC1.CN1CCOCC1.
What is the InChIKey of ethane;4-methylmorpholine;1-methylpiperazine;1-methylpiperidine?
The InChIKey is ZJLSLDRYNJRBEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N.C5H12N2.C5H11NO.3C2H6/c1-7-5-3-2-4-6-7;1-7-4-2-6-3-5-7;1-6-2-4-7-5-3-6;3*1-2/h2-6H2,1H3;6H,2-5H2,1H3;2-5H2,1H3;3*1-2H3.
What are the key properties of ethane;4-methylmorpholine;1-methylpiperazine;1-methylpiperidine?
ethane;4-methylmorpholine;1-methylpiperazine;1-methylpiperidine has a molecular weight of 390.70 g/mol, XLogP of 3.65, 0 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-methylmorpholine;1-methylpiperazine;1-methylpiperidine is sourced from PubChem (CID 145109143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).