5-(3,3-dimethylmorpholin-4-yl)-N-propan-2-ylpentan-1-amine

C14H30N2O — CID 62461860

IUPAC5-(3,3-dimethylmorpholin-4-yl)-N-propan-2-ylpentan-1-amine
SMILESCC(C)NCCCCCN1CCOCC1(C)C
InChIInChI=1S/C14H30N2O/c1-13(2)15-8-6-5-7-9-16-10-11-17-12-14(16,3)4/h13,15H,5-12H2,1-4H3
InChIKeyFKNOUQSEVBVBNF-UHFFFAOYSA-N
MW242.41 g/mol
LogP2.27
Rot. Bonds7

About 5-(3,3-dimethylmorpholin-4-yl)-N-propan-2-ylpentan-1-amine

5-(3,3-dimethylmorpholin-4-yl)-N-propan-2-ylpentan-1-amine (PubChem CID 62461860) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is 5-(3,3-dimethylmorpholin-4-yl)-N-propan-2-ylpentan-1-amine.

Molecular Properties

Compound Name5-(3,3-dimethylmorpholin-4-yl)-N-propan-2-ylpentan-1-amine
PubChem CID62461860
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC Name5-(3,3-dimethylmorpholin-4-yl)-N-propan-2-ylpentan-1-amine
SMILESCC(C)NCCCCCN1CCOCC1(C)C
InChIInChI=1S/C14H30N2O/c1-13(2)15-8-6-5-7-9-16-10-11-17-12-14(16,3)4/h13,15H,5-12H2,1-4H3
InChIKeyFKNOUQSEVBVBNF-UHFFFAOYSA-N
XLogP2.27
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 ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 5-(3,3-dimethylmorpholin-4-yl)-N-propan-2-ylpentan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-(3,3-dimethylmorpholin-4-yl)-N-propan-2-ylpentan-1-amine?
The IUPAC name of 5-(3,3-dimethylmorpholin-4-yl)-N-propan-2-ylpentan-1-amine (CID 62461860) is 5-(3,3-dimethylmorpholin-4-yl)-N-propan-2-ylpentan-1-amine.
What is the SMILES notation for 5-(3,3-dimethylmorpholin-4-yl)-N-propan-2-ylpentan-1-amine?
The canonical SMILES for 5-(3,3-dimethylmorpholin-4-yl)-N-propan-2-ylpentan-1-amine is CC(C)NCCCCCN1CCOCC1(C)C.
What is the InChIKey of 5-(3,3-dimethylmorpholin-4-yl)-N-propan-2-ylpentan-1-amine?
The InChIKey is FKNOUQSEVBVBNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-13(2)15-8-6-5-7-9-16-10-11-17-12-14(16,3)4/h13,15H,5-12H2,1-4H3.
What are the key properties of 5-(3,3-dimethylmorpholin-4-yl)-N-propan-2-ylpentan-1-amine?
5-(3,3-dimethylmorpholin-4-yl)-N-propan-2-ylpentan-1-amine has a molecular weight of 242.41 g/mol, XLogP of 2.27, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,3-dimethylmorpholin-4-yl)-N-propan-2-ylpentan-1-amine is sourced from PubChem (CID 62461860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).