3-morpholin-4-yl-N-propan-2-ylbutan-2-amine

C11H24N2O — CID 115905686

IUPAC3-morpholin-4-yl-N-propan-2-ylbutan-2-amine
SMILESCC(C)NC(C)C(C)N1CCOCC1
InChIInChI=1S/C11H24N2O/c1-9(2)12-10(3)11(4)13-5-7-14-8-6-13/h9-12H,5-8H2,1-4H3
InChIKeyHIEXRYWQJFDZOV-UHFFFAOYSA-N
MW200.33 g/mol
LogP1.09
Rot. Bonds4

About 3-morpholin-4-yl-N-propan-2-ylbutan-2-amine

3-morpholin-4-yl-N-propan-2-ylbutan-2-amine (PubChem CID 115905686) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is 3-morpholin-4-yl-N-propan-2-ylbutan-2-amine.

Molecular Properties

Compound Name3-morpholin-4-yl-N-propan-2-ylbutan-2-amine
PubChem CID115905686
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC Name3-morpholin-4-yl-N-propan-2-ylbutan-2-amine
SMILESCC(C)NC(C)C(C)N1CCOCC1
InChIInChI=1S/C11H24N2O/c1-9(2)12-10(3)11(4)13-5-7-14-8-6-13/h9-12H,5-8H2,1-4H3
InChIKeyHIEXRYWQJFDZOV-UHFFFAOYSA-N
XLogP1.09
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[3-(4-methylpiperazin-1-yl)butan-2-yl]morpholine
CID 167278501
bis(1,4-dioxane);N-propan-2-ylpropan-2-amine
CID 158831625
N,2-dimethyl-3-morpholin-4-ylbutan-1-amine
CID 79414599
trans-(1R,3R)-N-[(2S,3R)-3-morpholin-4-ylbutan-2-yl]-3-(trifluoromethyl)cyclohexan-1-amine
CID 129429871
fluoromethane;4-propan-2-ylmorpholine
CID 177187231
4-propan-2-yl-1,4-oxazepane;hydrate
CID 176712925
2-methyl-N-(2-methylpropyl)-3-(1,4-oxazepan-4-yl)butan-1-amine
CID 81019480
N-ethyl-2-methyl-3-(1,4-oxazepan-4-yl)butan-1-amine
CID 81019597
2-amino-2-methyl-N-(3-morpholin-4-ylbutan-2-yl)propanamide
CID 119878462
silver 1-morpholin-4-ylethanethiol
CID 19374206
N-[(2S,3S)-3-morpholin-4-ylbutan-2-yl]-1,4-dioxaspiro[4.5]decan-8-amine
CID 99701525
(2S)-2-amino-4-methyl-N-(3-morpholin-4-ylbutan-2-yl)pentanamide
CID 119878524

Frequently Asked Questions

What is the IUPAC name of 3-morpholin-4-yl-N-propan-2-ylbutan-2-amine?
The IUPAC name of 3-morpholin-4-yl-N-propan-2-ylbutan-2-amine (CID 115905686) is 3-morpholin-4-yl-N-propan-2-ylbutan-2-amine.
What is the SMILES notation for 3-morpholin-4-yl-N-propan-2-ylbutan-2-amine?
The canonical SMILES for 3-morpholin-4-yl-N-propan-2-ylbutan-2-amine is CC(C)NC(C)C(C)N1CCOCC1.
What is the InChIKey of 3-morpholin-4-yl-N-propan-2-ylbutan-2-amine?
The InChIKey is HIEXRYWQJFDZOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-9(2)12-10(3)11(4)13-5-7-14-8-6-13/h9-12H,5-8H2,1-4H3.
What are the key properties of 3-morpholin-4-yl-N-propan-2-ylbutan-2-amine?
3-morpholin-4-yl-N-propan-2-ylbutan-2-amine has a molecular weight of 200.33 g/mol, XLogP of 1.09, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-morpholin-4-yl-N-propan-2-ylbutan-2-amine is sourced from PubChem (CID 115905686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).