N,2-dimethyl-3-morpholin-4-ylbutan-1-amine

C10H22N2O — CID 79414599

IUPACN,2-dimethyl-3-morpholin-4-ylbutan-1-amine
SMILESCNCC(C)C(C)N1CCOCC1
InChIInChI=1S/C10H22N2O/c1-9(8-11-3)10(2)12-4-6-13-7-5-12/h9-11H,4-8H2,1-3H3
InChIKeyHQHNZDIHTBPAJV-UHFFFAOYSA-N
MW186.30 g/mol
LogP0.56
Rot. Bonds4

About N,2-dimethyl-3-morpholin-4-ylbutan-1-amine

N,2-dimethyl-3-morpholin-4-ylbutan-1-amine (PubChem CID 79414599) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is N,2-dimethyl-3-morpholin-4-ylbutan-1-amine.

Molecular Properties

Compound NameN,2-dimethyl-3-morpholin-4-ylbutan-1-amine
PubChem CID79414599
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC NameN,2-dimethyl-3-morpholin-4-ylbutan-1-amine
SMILESCNCC(C)C(C)N1CCOCC1
InChIInChI=1S/C10H22N2O/c1-9(8-11-3)10(2)12-4-6-13-7-5-12/h9-11H,4-8H2,1-3H3
InChIKeyHQHNZDIHTBPAJV-UHFFFAOYSA-N
XLogP0.56
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 50.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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
3-(3-ethylmorpholin-4-yl)-N,2-dimethylbutan-1-amine
CID 79408287
3-morpholin-4-yl-N-propan-2-ylbutan-2-amine
CID 115905686
4-[3-(4-methylpiperazin-1-yl)butan-2-yl]morpholine
CID 167278501
3-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-N,2-dimethylbutan-1-amine
CID 115562266
3-methyl-N-(2-morpholin-4-ylpropyl)pentan-2-amine
CID 115708392
3-(4-benzylpiperidin-1-yl)-N,2-dimethylbutan-1-amine
CID 79415056
(2S)-1-(methylamino)-3-morpholin-4-ylpropan-2-ol
CID 7201085
(2S)-3-methyl-2-morpholin-4-ylbutan-1-amine
CID 51624538
N-ethyl-4-morpholin-4-ylpentan-2-amine
CID 64706123
fluoromethane;4-propan-2-ylmorpholine
CID 177187231

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-3-morpholin-4-ylbutan-1-amine?
The IUPAC name of N,2-dimethyl-3-morpholin-4-ylbutan-1-amine (CID 79414599) is N,2-dimethyl-3-morpholin-4-ylbutan-1-amine.
What is the SMILES notation for N,2-dimethyl-3-morpholin-4-ylbutan-1-amine?
The canonical SMILES for N,2-dimethyl-3-morpholin-4-ylbutan-1-amine is CNCC(C)C(C)N1CCOCC1.
What is the InChIKey of N,2-dimethyl-3-morpholin-4-ylbutan-1-amine?
The InChIKey is HQHNZDIHTBPAJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-9(8-11-3)10(2)12-4-6-13-7-5-12/h9-11H,4-8H2,1-3H3.
What are the key properties of N,2-dimethyl-3-morpholin-4-ylbutan-1-amine?
N,2-dimethyl-3-morpholin-4-ylbutan-1-amine has a molecular weight of 186.30 g/mol, XLogP of 0.56, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-3-morpholin-4-ylbutan-1-amine is sourced from PubChem (CID 79414599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).