3-morpholin-4-yl-N-(3-morpholin-4-ylpropyl)propan-1-amine

C14H29N3O2 — CID 19869475

IUPAC3-morpholin-4-yl-N-(3-morpholin-4-ylpropyl)propan-1-amine
SMILESC(CNCCCN1CCOCC1)CN1CCOCC1
InChIInChI=1S/C14H29N3O2/c1(5-16-7-11-18-12-8-16)3-15-4-2-6-17-9-13-19-14-10-17/h15H,1-14H2
InChIKeyNRIAQGAVWHTZJV-UHFFFAOYSA-N
MW271.40 g/mol
LogP0.02
Rot. Bonds8

About 3-morpholin-4-yl-N-(3-morpholin-4-ylpropyl)propan-1-amine

3-morpholin-4-yl-N-(3-morpholin-4-ylpropyl)propan-1-amine (PubChem CID 19869475) has the molecular formula C14H29N3O2 and a molecular weight of 271.40 g/mol. Its IUPAC name is 3-morpholin-4-yl-N-(3-morpholin-4-ylpropyl)propan-1-amine.

Molecular Properties

Compound Name3-morpholin-4-yl-N-(3-morpholin-4-ylpropyl)propan-1-amine
PubChem CID19869475
Molecular FormulaC14H29N3O2
Molecular Weight271.40 g/mol
Exact Mass271.23
IUPAC Name3-morpholin-4-yl-N-(3-morpholin-4-ylpropyl)propan-1-amine
SMILESC(CNCCCN1CCOCC1)CN1CCOCC1
InChIInChI=1S/C14H29N3O2/c1(5-16-7-11-18-12-8-16)3-15-4-2-6-17-9-13-19-14-10-17/h15H,1-14H2
InChIKeyNRIAQGAVWHTZJV-UHFFFAOYSA-N
XLogP0.02
TPSA36.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.40
LogP ≤ 50.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 3-morpholin-4-yl-N-(3-morpholin-4-ylpropyl)propan-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 3-morpholin-4-yl-N-(3-morpholin-4-ylpropyl)propan-1-amine?
The IUPAC name of 3-morpholin-4-yl-N-(3-morpholin-4-ylpropyl)propan-1-amine (CID 19869475) is 3-morpholin-4-yl-N-(3-morpholin-4-ylpropyl)propan-1-amine.
What is the SMILES notation for 3-morpholin-4-yl-N-(3-morpholin-4-ylpropyl)propan-1-amine?
The canonical SMILES for 3-morpholin-4-yl-N-(3-morpholin-4-ylpropyl)propan-1-amine is C(CNCCCN1CCOCC1)CN1CCOCC1.
What is the InChIKey of 3-morpholin-4-yl-N-(3-morpholin-4-ylpropyl)propan-1-amine?
The InChIKey is NRIAQGAVWHTZJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O2/c1(5-16-7-11-18-12-8-16)3-15-4-2-6-17-9-13-19-14-10-17/h15H,1-14H2.
What are the key properties of 3-morpholin-4-yl-N-(3-morpholin-4-ylpropyl)propan-1-amine?
3-morpholin-4-yl-N-(3-morpholin-4-ylpropyl)propan-1-amine has a molecular weight of 271.40 g/mol, XLogP of 0.02, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-morpholin-4-yl-N-(3-morpholin-4-ylpropyl)propan-1-amine is sourced from PubChem (CID 19869475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).