methane;5-propan-2-yl-3,4-dihydro-2H-pyrrole;4-propan-2-ylmorpholine

C15H32N2O — CID 167700376

IUPACmethane;5-propan-2-yl-3,4-dihydro-2H-pyrrole;4-propan-2-ylmorpholine
SMILESC.CC(C)C1=NCCC1.CC(C)N1CCOCC1
InChIInChI=1S/C7H15NO.C7H13N.CH4/c1-7(2)8-3-5-9-6-4-8;1-6(2)7-4-3-5-8-7;/h7H,3-6H2,1-2H3;6H,3-5H2,1-2H3;1H4
InChIKeyYHFPUYIRMZZVCC-UHFFFAOYSA-N
MW256.43 g/mol
LogP3.24
Rot. Bonds2

About methane;5-propan-2-yl-3,4-dihydro-2H-pyrrole;4-propan-2-ylmorpholine

methane;5-propan-2-yl-3,4-dihydro-2H-pyrrole;4-propan-2-ylmorpholine (PubChem CID 167700376) has the molecular formula C15H32N2O and a molecular weight of 256.43 g/mol. Its IUPAC name is methane;5-propan-2-yl-3,4-dihydro-2H-pyrrole;4-propan-2-ylmorpholine.

Molecular Properties

Compound Namemethane;5-propan-2-yl-3,4-dihydro-2H-pyrrole;4-propan-2-ylmorpholine
PubChem CID167700376
Molecular FormulaC15H32N2O
Molecular Weight256.43 g/mol
Exact Mass256.25
IUPAC Namemethane;5-propan-2-yl-3,4-dihydro-2H-pyrrole;4-propan-2-ylmorpholine
SMILESC.CC(C)C1=NCCC1.CC(C)N1CCOCC1
InChIInChI=1S/C7H15NO.C7H13N.CH4/c1-7(2)8-3-5-9-6-4-8;1-6(2)7-4-3-5-8-7;/h7H,3-6H2,1-2H3;6H,3-5H2,1-2H3;1H4
InChIKeyYHFPUYIRMZZVCC-UHFFFAOYSA-N
XLogP3.24
TPSA24.83 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.43
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-propan-2-yl-3,4-dihydro-2H-pyrrole;1-propan-2-ylpiperidine
CID 159231383
fluoromethane;4-propan-2-ylmorpholine
CID 177187231
4-propan-2-yl-1,4-oxazepane;hydrate
CID 176712925
butane;methane;4-propan-2-ylmorpholine;yttrium
CID 158385716
1-methylpiperidine;4-propan-2-ylmorpholine
CID 176969911
1,4-di(propan-2-yl)piperazine;tetrakis(2-methylpropane);1-methyl-4-propan-2-ylpiperazine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine
CID 158438628
methane;4-propan-2-yl-3,6-dihydro-2H-pyran;4-propan-2-ylmorpholine;4-propan-2-yloxane
CID 158315052
ethane;4-propan-2-ylmorpholine;4-propan-2-yloxane;bis(1-propan-2-ylpiperidine)
CID 161339699
1-propan-2-ylazepane;1-propan-2-ylazetidine;1-propan-2-ylazocane;1-propan-2-yl-1,4-diazepane;4-propan-2-ylmorpholine;1-propan-2-ylpiperazine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine
CID 158844378
2-(3,4-dihydro-2H-pyrrol-5-yl)propan-1-ol
CID 176895008
1-propan-2-ylazetidine;1-propan-2-ylimidazolidine;4-propan-2-ylmorpholine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine
CID 167703240
4-[1-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)ethyl]morpholine
CID 162634845

Frequently Asked Questions

What is the IUPAC name of methane;5-propan-2-yl-3,4-dihydro-2H-pyrrole;4-propan-2-ylmorpholine?
The IUPAC name of methane;5-propan-2-yl-3,4-dihydro-2H-pyrrole;4-propan-2-ylmorpholine (CID 167700376) is methane;5-propan-2-yl-3,4-dihydro-2H-pyrrole;4-propan-2-ylmorpholine.
What is the SMILES notation for methane;5-propan-2-yl-3,4-dihydro-2H-pyrrole;4-propan-2-ylmorpholine?
The canonical SMILES for methane;5-propan-2-yl-3,4-dihydro-2H-pyrrole;4-propan-2-ylmorpholine is C.CC(C)C1=NCCC1.CC(C)N1CCOCC1.
What is the InChIKey of methane;5-propan-2-yl-3,4-dihydro-2H-pyrrole;4-propan-2-ylmorpholine?
The InChIKey is YHFPUYIRMZZVCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO.C7H13N.CH4/c1-7(2)8-3-5-9-6-4-8;1-6(2)7-4-3-5-8-7;/h7H,3-6H2,1-2H3;6H,3-5H2,1-2H3;1H4.
What are the key properties of methane;5-propan-2-yl-3,4-dihydro-2H-pyrrole;4-propan-2-ylmorpholine?
methane;5-propan-2-yl-3,4-dihydro-2H-pyrrole;4-propan-2-ylmorpholine has a molecular weight of 256.43 g/mol, XLogP of 3.24, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methane;5-propan-2-yl-3,4-dihydro-2H-pyrrole;4-propan-2-ylmorpholine is sourced from PubChem (CID 167700376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).