methane;1-methyl-4-(2-methylpropyl)piperazine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)piperazine;1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine;N,N,2-trimethylpropan-1-amine

C49H110N8O — CID 158024937

IUPACmethane;1-methyl-4-(2-methylpropyl)piperazine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)piperazine;1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine;N,N,2-trimethylpropan-1-amine
SMILESC.CC(C)CN(C)C.CC(C)CN1CCCC1.CC(C)CN1CCCCC1.CC(C)CN1CCN(C)CC1.CC(C)CN1CCNCC1.CC(C)CN1CCOCC1
InChIInChI=1S/C9H20N2.C9H19N.C8H18N2.C8H17NO.C8H17N.C6H15N.CH4/c1-9(2)8-11-6-4-10(3)5-7-11;1-9(2)8-10-6-4-3-5-7-10;1-8(2)7-10-5-3-9-4-6-10;1-8(2)7-9-3-5-10-6-4-9;1-8(2)7-9-5-3-4-6-9;1-6(2)5-7(3)4;/h9H,4-8H2,1-3H3;9H,3-8H2,1-2H3;8-9H,3-7H2,1-2H3;8H,3-7H2,1-2H3;8H,3-7H2,1-2H3;6H,5H2,1-4H3;1H4
InChIKeyFGMKWDHCSQNXLZ-UHFFFAOYSA-N
MW827.47 g/mol
LogP8.12
Rot. Bonds12

About methane;1-methyl-4-(2-methylpropyl)piperazine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)piperazine;1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine;N,N,2-trimethylpropan-1-amine

methane;1-methyl-4-(2-methylpropyl)piperazine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)piperazine;1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine;N,N,2-trimethylpropan-1-amine (PubChem CID 158024937) has the molecular formula C49H110N8O and a molecular weight of 827.47 g/mol. Its IUPAC name is methane;1-methyl-4-(2-methylpropyl)piperazine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)piperazine;1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine;N,N,2-trimethylpropan-1-amine.

Molecular Properties

Compound Namemethane;1-methyl-4-(2-methylpropyl)piperazine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)piperazine;1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine;N,N,2-trimethylpropan-1-amine
PubChem CID158024937
Molecular FormulaC49H110N8O
Molecular Weight827.47 g/mol
Exact Mass826.88
IUPAC Namemethane;1-methyl-4-(2-methylpropyl)piperazine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)piperazine;1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine;N,N,2-trimethylpropan-1-amine
SMILESC.CC(C)CN(C)C.CC(C)CN1CCCC1.CC(C)CN1CCCCC1.CC(C)CN1CCN(C)CC1.CC(C)CN1CCNCC1.CC(C)CN1CCOCC1
InChIInChI=1S/C9H20N2.C9H19N.C8H18N2.C8H17NO.C8H17N.C6H15N.CH4/c1-9(2)8-11-6-4-10(3)5-7-11;1-9(2)8-10-6-4-3-5-7-10;1-8(2)7-10-5-3-9-4-6-10;1-8(2)7-9-3-5-10-6-4-9;1-8(2)7-9-5-3-4-6-9;1-6(2)5-7(3)4;/h9H,4-8H2,1-3H3;9H,3-8H2,1-2H3;8-9H,3-7H2,1-2H3;8H,3-7H2,1-2H3;8H,3-7H2,1-2H3;6H,5H2,1-4H3;1H4
InChIKeyFGMKWDHCSQNXLZ-UHFFFAOYSA-N
XLogP8.12
TPSA43.94 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds12
Heavy Atoms58
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500827.47
LogP ≤ 58.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Analyze methane;1-methyl-4-(2-methylpropyl)piperazine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)piperazine;1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine;N,N,2-trimethylpropan-1-amine with MolForge

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Launch Full Analysis

Related Compounds

4-(4-Methyl-2-piperazin-1-yl-3-piperidin-1-yl-3-pyrrolidin-1-ylpiperazin-2-yl)morpholine
CID 54485847
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-(4-Methylpiperazin-1-yl)morpholine;3-methylpiperidine;4-methylpiperidine
CID 143224692
4-Methylmorpholine;1-methylpiperazine;1-methylpiperidine;1-methylpyrrolidine
CID 144057730
ethane;4-[1-(2-methylpropyl)piperidin-4-yl]morpholine;piperidine;N,N,1-triethylpiperidin-4-amine
CID 145336541
Ethane;1-ethyl-4-[2-(1-propylpiperidin-4-yl)oxyethyl]piperazine;1-[2-(1-propylpiperidin-4-yl)oxyethyl]piperazine
CID 156885090
Ethane;1-[2-(1-ethylpiperidin-4-yl)oxyethyl]-4-methylpiperazine;1-[2-(1-ethylpiperidin-4-yl)oxyethyl]piperazine
CID 156885685
methane;3-methylbutan-1-amine;4-(3-methylbutyl)morpholine;bis(1-(3-methylbutyl)piperazine);N-(3-methylbutyl)piperidin-4-amine;1-(3-methylbutyl)piperidine;1-(3-methylbutyl)pyrrolidine;1-methyl-4-(3-methylbutyl)piperazine
CID 157192131
1,4-dimethylpiperazine;1,3-dimethylpiperidine;1,4-dimethylpiperidine;1-ethyl-4-methylpiperazine;4-methylmorpholine;1-methylpiperidine;(3R)-3-methylpiperidine
CID 157291544
ethane;methane;1-methyl-4-(2-methylpropyl)piperazine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)piperazine;1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine;N,N,2-trimethylpropan-1-amine
CID 157532905
1-Tert-butylpyrrolidine;tris(2-methylpropane);morpholine;piperazine;piperidine
CID 157537968

Frequently Asked Questions

What is the IUPAC name of methane;1-methyl-4-(2-methylpropyl)piperazine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)piperazine;1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine;N,N,2-trimethylpropan-1-amine?
The IUPAC name of methane;1-methyl-4-(2-methylpropyl)piperazine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)piperazine;1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine;N,N,2-trimethylpropan-1-amine (CID 158024937) is methane;1-methyl-4-(2-methylpropyl)piperazine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)piperazine;1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine;N,N,2-trimethylpropan-1-amine.
What is the SMILES notation for methane;1-methyl-4-(2-methylpropyl)piperazine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)piperazine;1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine;N,N,2-trimethylpropan-1-amine?
The canonical SMILES for methane;1-methyl-4-(2-methylpropyl)piperazine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)piperazine;1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine;N,N,2-trimethylpropan-1-amine is C.CC(C)CN(C)C.CC(C)CN1CCCC1.CC(C)CN1CCCCC1.CC(C)CN1CCN(C)CC1.CC(C)CN1CCNCC1.CC(C)CN1CCOCC1.
What is the InChIKey of methane;1-methyl-4-(2-methylpropyl)piperazine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)piperazine;1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine;N,N,2-trimethylpropan-1-amine?
The InChIKey is FGMKWDHCSQNXLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2.C9H19N.C8H18N2.C8H17NO.C8H17N.C6H15N.CH4/c1-9(2)8-11-6-4-10(3)5-7-11;1-9(2)8-10-6-4-3-5-7-10;1-8(2)7-10-5-3-9-4-6-10;1-8(2)7-9-3-5-10-6-4-9;1-8(2)7-9-5-3-4-6-9;1-6(2)5-7(3)4;/h9H,4-8H2,1-3H3;9H,3-8H2,1-2H3;8-9H,3-7H2,1-2H3;8H,3-7H2,1-2H3;8H,3-7H2,1-2H3;6H,5H2,1-4H3;1H4.
What are the key properties of methane;1-methyl-4-(2-methylpropyl)piperazine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)piperazine;1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine;N,N,2-trimethylpropan-1-amine?
methane;1-methyl-4-(2-methylpropyl)piperazine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)piperazine;1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine;N,N,2-trimethylpropan-1-amine has a molecular weight of 827.47 g/mol, XLogP of 8.12, 12 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for methane;1-methyl-4-(2-methylpropyl)piperazine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)piperazine;1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine;N,N,2-trimethylpropan-1-amine is sourced from PubChem (CID 158024937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).