ethane;4-(2-methylbutyl)morpholine

C11H25NO — CID 142525427

IUPACethane;4-(2-methylbutyl)morpholine
SMILESCC.CCC(C)CN1CCOCC1
InChIInChI=1S/C9H19NO.C2H6/c1-3-9(2)8-10-4-6-11-7-5-10;1-2/h9H,3-8H2,1-2H3;1-2H3
InChIKeyOXTSXZPLRXCYNB-UHFFFAOYSA-N
MW187.33 g/mol
LogP2.39
Rot. Bonds3

About ethane;4-(2-methylbutyl)morpholine

ethane;4-(2-methylbutyl)morpholine (PubChem CID 142525427) has the molecular formula C11H25NO and a molecular weight of 187.33 g/mol. Its IUPAC name is ethane;4-(2-methylbutyl)morpholine.

Molecular Properties

Compound Nameethane;4-(2-methylbutyl)morpholine
PubChem CID142525427
Molecular FormulaC11H25NO
Molecular Weight187.33 g/mol
Exact Mass187.19
IUPAC Nameethane;4-(2-methylbutyl)morpholine
SMILESCC.CCC(C)CN1CCOCC1
InChIInChI=1S/C9H19NO.C2H6/c1-3-9(2)8-10-4-6-11-7-5-10;1-2/h9H,3-8H2,1-2H3;1-2H3
InChIKeyOXTSXZPLRXCYNB-UHFFFAOYSA-N
XLogP2.39
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.33
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-N-(1-morpholin-4-ylpropan-2-yl)butan-1-amine
CID 43675679
N-butan-2-yl-2-methyl-3-morpholin-4-ylpropan-1-amine
CID 115722394
trimethyl-(2-methyl-3-morpholin-4-ylpropyl)silane
CID 10488877
4-[(3S)-3-methylpentyl]morpholine
CID 167092878
butane;4-(2-methylpropyl)morpholine
CID 155751822
(3S)-2-methyl-N-[(2R)-2-methyl-3-morpholin-4-ylpropyl]pentan-3-amine
CID 97232472
4-[(2S)-2-methyl-3-propan-2-yloxypropyl]morpholine
CID 172528802
3-methyl-4-morpholin-4-ylbutanal
CID 115013883
1-methyl-4-[(2S)-2-methylbutyl]piperazine
CID 130224614
1-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butan-2-ol
CID 129310449
1-(2-bromoethyl)-4-(2-methylbutyl)piperazine
CID 80674253
4-[(2R)-1-morpholin-4-ylpropan-2-yl]morpholine
CID 28775628

Frequently Asked Questions

What is the IUPAC name of ethane;4-(2-methylbutyl)morpholine?
The IUPAC name of ethane;4-(2-methylbutyl)morpholine (CID 142525427) is ethane;4-(2-methylbutyl)morpholine.
What is the SMILES notation for ethane;4-(2-methylbutyl)morpholine?
The canonical SMILES for ethane;4-(2-methylbutyl)morpholine is CC.CCC(C)CN1CCOCC1.
What is the InChIKey of ethane;4-(2-methylbutyl)morpholine?
The InChIKey is OXTSXZPLRXCYNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO.C2H6/c1-3-9(2)8-10-4-6-11-7-5-10;1-2/h9H,3-8H2,1-2H3;1-2H3.
What are the key properties of ethane;4-(2-methylbutyl)morpholine?
ethane;4-(2-methylbutyl)morpholine has a molecular weight of 187.33 g/mol, XLogP of 2.39, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-(2-methylbutyl)morpholine is sourced from PubChem (CID 142525427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).