methane;1-methylpiperazine;morpholine;piperazine;piperidine;pyrrolidine

C23H55N7O — CID 158041768

IUPACmethane;1-methylpiperazine;morpholine;piperazine;piperidine;pyrrolidine
SMILESC.C1CCNC1.C1CCNCC1.C1CNCCN1.C1COCCN1.CN1CCNCC1
InChIInChI=1S/C5H12N2.C5H11N.C4H10N2.C4H9NO.C4H9N.CH4/c1-7-4-2-6-3-5-7;1-2-4-6-5-3-1;1-2-6-4-3-5-1;1-3-6-4-2-5-1;1-2-4-5-3-1;/h6H,2-5H2,1H3;6H,1-5H2;5-6H,1-4H2;5H,1-4H2;5H,1-4H2;1H4
InChIKeyFIKYSMRALDOPOW-UHFFFAOYSA-N
MW445.74 g/mol
LogP0.07
Rot. Bonds

About methane;1-methylpiperazine;morpholine;piperazine;piperidine;pyrrolidine

methane;1-methylpiperazine;morpholine;piperazine;piperidine;pyrrolidine (PubChem CID 158041768) has the molecular formula C23H55N7O and a molecular weight of 445.74 g/mol. Its IUPAC name is methane;1-methylpiperazine;morpholine;piperazine;piperidine;pyrrolidine.

Molecular Properties

Compound Namemethane;1-methylpiperazine;morpholine;piperazine;piperidine;pyrrolidine
PubChem CID158041768
Molecular FormulaC23H55N7O
Molecular Weight445.74 g/mol
Exact Mass445.45
IUPAC Namemethane;1-methylpiperazine;morpholine;piperazine;piperidine;pyrrolidine
SMILESC.C1CCNC1.C1CCNCC1.C1CNCCN1.C1COCCN1.CN1CCNCC1
InChIInChI=1S/C5H12N2.C5H11N.C4H10N2.C4H9NO.C4H9N.CH4/c1-7-4-2-6-3-5-7;1-2-4-6-5-3-1;1-2-6-4-3-5-1;1-3-6-4-2-5-1;1-2-4-5-3-1;/h6H,2-5H2,1H3;6H,1-5H2;5-6H,1-4H2;5H,1-4H2;5H,1-4H2;1H4
InChIKeyFIKYSMRALDOPOW-UHFFFAOYSA-N
XLogP0.07
TPSA84.65 Ų
H-Bond Donors6
H-Bond Acceptors8
Rotatable Bonds
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500445.74
LogP ≤ 50.07
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 108

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Related Compounds

4-(3-Piperidin-1-yl-3-pyrrolidin-1-ylpiperazin-2-yl)morpholine
CID 53663701
4-(4-Methyl-2-piperazin-1-yl-3-piperidin-1-yl-3-pyrrolidin-1-ylpiperazin-2-yl)morpholine
CID 54485847
2,2-Di(piperidin-1-yl)-3-pyrrolidin-1-ylmorpholine
CID 56631290
2-Methylpiperidine;4-(2-piperazin-1-ylethyl)morpholine
CID 68616628
1-(2-Morpholin-4-ylethyl)piperidin-4-amine
CID 70274947
3-Piperazin-1-yl-2-piperidin-1-yl-3-pyrrolidin-1-ylmorpholine
CID 90694084
4-[3-(4-Methylpiperazin-1-yl)-2-piperidin-1-ylpiperidin-2-yl]morpholine
CID 90903170
4-[3-(4-Methylpiperazin-1-yl)-2-piperazin-1-ylpiperidin-2-yl]morpholine
CID 90903647
4-[3-(4-Methylpiperazin-1-yl)-3-piperazin-1-yl-2-piperidin-1-ylpyrrolidin-2-yl]morpholine
CID 91151109
2-(4-Methylpiperazin-1-yl)-3-piperazin-1-yl-3-piperidin-1-yl-2-pyrrolidin-1-ylmorpholine
CID 123334449
4-(2-Piperazin-1-yl-2-piperidin-1-yl-3-pyrrolidin-1-ylpiperazin-1-yl)morpholine
CID 141134793
Morpholin-4-yl-piperazin-1-yl-piperidin-1-yl-pyrrolidin-1-yl-lambda4-sulfane
CID 141190642

Frequently Asked Questions

What is the IUPAC name of methane;1-methylpiperazine;morpholine;piperazine;piperidine;pyrrolidine?
The IUPAC name of methane;1-methylpiperazine;morpholine;piperazine;piperidine;pyrrolidine (CID 158041768) is methane;1-methylpiperazine;morpholine;piperazine;piperidine;pyrrolidine.
What is the SMILES notation for methane;1-methylpiperazine;morpholine;piperazine;piperidine;pyrrolidine?
The canonical SMILES for methane;1-methylpiperazine;morpholine;piperazine;piperidine;pyrrolidine is C.C1CCNC1.C1CCNCC1.C1CNCCN1.C1COCCN1.CN1CCNCC1.
What is the InChIKey of methane;1-methylpiperazine;morpholine;piperazine;piperidine;pyrrolidine?
The InChIKey is FIKYSMRALDOPOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2.C5H11N.C4H10N2.C4H9NO.C4H9N.CH4/c1-7-4-2-6-3-5-7;1-2-4-6-5-3-1;1-2-6-4-3-5-1;1-3-6-4-2-5-1;1-2-4-5-3-1;/h6H,2-5H2,1H3;6H,1-5H2;5-6H,1-4H2;5H,1-4H2;5H,1-4H2;1H4.
What are the key properties of methane;1-methylpiperazine;morpholine;piperazine;piperidine;pyrrolidine?
methane;1-methylpiperazine;morpholine;piperazine;piperidine;pyrrolidine has a molecular weight of 445.74 g/mol, XLogP of 0.07, 0 rotatable bonds, 6 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for methane;1-methylpiperazine;morpholine;piperazine;piperidine;pyrrolidine is sourced from PubChem (CID 158041768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).