4-(2,5-dimethylmorpholin-4-yl)-N-(2-methylpropyl)butan-1-amine

C14H30N2O — CID 62432075

IUPAC4-(2,5-dimethylmorpholin-4-yl)-N-(2-methylpropyl)butan-1-amine
SMILESCC(C)CNCCCCN1CC(C)OCC1C
InChIInChI=1S/C14H30N2O/c1-12(2)9-15-7-5-6-8-16-10-14(4)17-11-13(16)3/h12-15H,5-11H2,1-4H3
InChIKeyORHQLJVMYOGAGA-UHFFFAOYSA-N
MW242.41 g/mol
LogP2.12
Rot. Bonds7

About 4-(2,5-dimethylmorpholin-4-yl)-N-(2-methylpropyl)butan-1-amine

4-(2,5-dimethylmorpholin-4-yl)-N-(2-methylpropyl)butan-1-amine (PubChem CID 62432075) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is 4-(2,5-dimethylmorpholin-4-yl)-N-(2-methylpropyl)butan-1-amine.

Molecular Properties

Compound Name4-(2,5-dimethylmorpholin-4-yl)-N-(2-methylpropyl)butan-1-amine
PubChem CID62432075
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC Name4-(2,5-dimethylmorpholin-4-yl)-N-(2-methylpropyl)butan-1-amine
SMILESCC(C)CNCCCCN1CC(C)OCC1C
InChIInChI=1S/C14H30N2O/c1-12(2)9-15-7-5-6-8-16-10-14(4)17-11-13(16)3/h12-15H,5-11H2,1-4H3
InChIKeyORHQLJVMYOGAGA-UHFFFAOYSA-N
XLogP2.12
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-(2,5-dimethylmorpholin-4-yl)propan-1-ol
CID 43430768
N-[2-(2,5-dimethylmorpholin-4-yl)propyl]-2-methylpropan-1-amine
CID 62432439
methyl 4-(2,5-dimethylmorpholin-4-yl)butanoate
CID 43544788
N-[[2-[(2,5-dimethylmorpholin-4-yl)methyl]phenyl]methyl]-2-methylpropan-1-amine
CID 62432447
N-[2-(2,5-dimethylmorpholin-4-yl)propyl]butan-1-amine
CID 62569533
N-[2-(2,5-dimethylmorpholin-4-yl)ethyl]cyclopropanamine
CID 60841046
4-(3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazin-4-yl)-N-(2-methylpropyl)butan-1-amine
CID 62436396
2-methyl-N-[3-(oxiran-2-yl)propyl]propan-1-amine
CID 142537270
4-(2-iodoethyl)-2,5-dimethylmorpholine
CID 130977867
N-[[3-[(2,5-dimethylmorpholin-4-yl)methyl]furan-2-yl]methyl]-2-methylpropan-1-amine
CID 62431715
N-(2-methylpropyl)-5-(2,2,6-trimethylmorpholin-4-yl)pentan-1-amine
CID 62435981
2-amino-4-(2,5-dimethylmorpholin-4-yl)butanamide
CID 63029627

Frequently Asked Questions

What is the IUPAC name of 4-(2,5-dimethylmorpholin-4-yl)-N-(2-methylpropyl)butan-1-amine?
The IUPAC name of 4-(2,5-dimethylmorpholin-4-yl)-N-(2-methylpropyl)butan-1-amine (CID 62432075) is 4-(2,5-dimethylmorpholin-4-yl)-N-(2-methylpropyl)butan-1-amine.
What is the SMILES notation for 4-(2,5-dimethylmorpholin-4-yl)-N-(2-methylpropyl)butan-1-amine?
The canonical SMILES for 4-(2,5-dimethylmorpholin-4-yl)-N-(2-methylpropyl)butan-1-amine is CC(C)CNCCCCN1CC(C)OCC1C.
What is the InChIKey of 4-(2,5-dimethylmorpholin-4-yl)-N-(2-methylpropyl)butan-1-amine?
The InChIKey is ORHQLJVMYOGAGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-12(2)9-15-7-5-6-8-16-10-14(4)17-11-13(16)3/h12-15H,5-11H2,1-4H3.
What are the key properties of 4-(2,5-dimethylmorpholin-4-yl)-N-(2-methylpropyl)butan-1-amine?
4-(2,5-dimethylmorpholin-4-yl)-N-(2-methylpropyl)butan-1-amine has a molecular weight of 242.41 g/mol, XLogP of 2.12, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,5-dimethylmorpholin-4-yl)-N-(2-methylpropyl)butan-1-amine is sourced from PubChem (CID 62432075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).