4-methyl-2-(3-methylbutyl)morpholine

C10H21NO — CID 59613546

IUPAC4-methyl-2-(3-methylbutyl)morpholine
SMILESCC(C)CCC1CN(C)CCO1
InChIInChI=1S/C10H21NO/c1-9(2)4-5-10-8-11(3)6-7-12-10/h9-10H,4-8H2,1-3H3
InChIKeyYXVDRVNLSNFHHU-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.75
Rot. Bonds3

About 4-methyl-2-(3-methylbutyl)morpholine

4-methyl-2-(3-methylbutyl)morpholine (PubChem CID 59613546) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 4-methyl-2-(3-methylbutyl)morpholine.

Molecular Properties

Compound Name4-methyl-2-(3-methylbutyl)morpholine
PubChem CID59613546
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name4-methyl-2-(3-methylbutyl)morpholine
SMILESCC(C)CCC1CN(C)CCO1
InChIInChI=1S/C10H21NO/c1-9(2)4-5-10-8-11(3)6-7-12-10/h9-10H,4-8H2,1-3H3
InChIKeyYXVDRVNLSNFHHU-UHFFFAOYSA-N
XLogP1.75
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-methylmorpholin-2-yl)ethanamine
CID 19961939
(2S)-2-(3-methylbutyl)-4-(2-methylpropyl)morpholine
CID 161175783
2-methyldecan-5-amine;4-methyl-2-(4-methylpentyl)morpholine
CID 176694052
N-[[(2S)-4-methylmorpholin-2-yl]methyl]propan-2-amine
CID 96645037
2-[2-(3-ethylcyclobutyl)ethyl]-4-methylmorpholine
CID 170953530
(2S)-4-methyl-N-[[(2S)-4-methylmorpholin-2-yl]methyl]pentan-2-amine
CID 97045041
4-methyl-N-[(4-methylmorpholin-2-yl)methyl]pentan-2-amine
CID 75356159
ethane;2-ethyl-4-methylmorpholine;methane
CID 178051294
(2R)-2,4-bis(4-methylpentyl)morpholine
CID 149421762
ethane;3-[(2R)-4-methylmorpholin-2-yl]propanoic acid
CID 145006678
N',2-dimethyl-N'-[(4-methylmorpholin-2-yl)methyl]propane-1,3-diamine
CID 79171481
imino-methyl-[2-(4-methylmorpholin-2-yl)ethyl]-oxo-λ6-sulfane
CID 176694081

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(3-methylbutyl)morpholine?
The IUPAC name of 4-methyl-2-(3-methylbutyl)morpholine (CID 59613546) is 4-methyl-2-(3-methylbutyl)morpholine.
What is the SMILES notation for 4-methyl-2-(3-methylbutyl)morpholine?
The canonical SMILES for 4-methyl-2-(3-methylbutyl)morpholine is CC(C)CCC1CN(C)CCO1.
What is the InChIKey of 4-methyl-2-(3-methylbutyl)morpholine?
The InChIKey is YXVDRVNLSNFHHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-9(2)4-5-10-8-11(3)6-7-12-10/h9-10H,4-8H2,1-3H3.
What are the key properties of 4-methyl-2-(3-methylbutyl)morpholine?
4-methyl-2-(3-methylbutyl)morpholine has a molecular weight of 171.28 g/mol, XLogP of 1.75, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(3-methylbutyl)morpholine is sourced from PubChem (CID 59613546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).