N-(3-morpholin-4-ylpropyl)nonan-2-amine

C16H34N2O — CID 43130029

IUPACN-(3-morpholin-4-ylpropyl)nonan-2-amine
SMILESCCCCCCCC(C)NCCCN1CCOCC1
InChIInChI=1S/C16H34N2O/c1-3-4-5-6-7-9-16(2)17-10-8-11-18-12-14-19-15-13-18/h16-17H,3-15H2,1-2H3
InChIKeyRTDXBQTWZWYQCU-UHFFFAOYSA-N
MW270.46 g/mol
LogP3.05
Rot. Bonds11

About N-(3-morpholin-4-ylpropyl)nonan-2-amine

N-(3-morpholin-4-ylpropyl)nonan-2-amine (PubChem CID 43130029) has the molecular formula C16H34N2O and a molecular weight of 270.46 g/mol. Its IUPAC name is N-(3-morpholin-4-ylpropyl)nonan-2-amine.

Molecular Properties

Compound NameN-(3-morpholin-4-ylpropyl)nonan-2-amine
PubChem CID43130029
Molecular FormulaC16H34N2O
Molecular Weight270.46 g/mol
Exact Mass270.27
IUPAC NameN-(3-morpholin-4-ylpropyl)nonan-2-amine
SMILESCCCCCCCC(C)NCCCN1CCOCC1
InChIInChI=1S/C16H34N2O/c1-3-4-5-6-7-9-16(2)17-10-8-11-18-12-14-19-15-13-18/h16-17H,3-15H2,1-2H3
InChIKeyRTDXBQTWZWYQCU-UHFFFAOYSA-N
XLogP3.05
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.46
LogP ≤ 53.05
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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Frequently Asked Questions

What is the IUPAC name of N-(3-morpholin-4-ylpropyl)nonan-2-amine?
The IUPAC name of N-(3-morpholin-4-ylpropyl)nonan-2-amine (CID 43130029) is N-(3-morpholin-4-ylpropyl)nonan-2-amine.
What is the SMILES notation for N-(3-morpholin-4-ylpropyl)nonan-2-amine?
The canonical SMILES for N-(3-morpholin-4-ylpropyl)nonan-2-amine is CCCCCCCC(C)NCCCN1CCOCC1.
What is the InChIKey of N-(3-morpholin-4-ylpropyl)nonan-2-amine?
The InChIKey is RTDXBQTWZWYQCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2O/c1-3-4-5-6-7-9-16(2)17-10-8-11-18-12-14-19-15-13-18/h16-17H,3-15H2,1-2H3.
What are the key properties of N-(3-morpholin-4-ylpropyl)nonan-2-amine?
N-(3-morpholin-4-ylpropyl)nonan-2-amine has a molecular weight of 270.46 g/mol, XLogP of 3.05, 11 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-morpholin-4-ylpropyl)nonan-2-amine is sourced from PubChem (CID 43130029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).