methane;morpholine;N-(morpholin-4-ylmethyl)pentan-1-amine

C15H35N3O2 — CID 174432896

IUPACmethane;morpholine;N-(morpholin-4-ylmethyl)pentan-1-amine
SMILESC.C1COCCN1.CCCCCNCN1CCOCC1
InChIInChI=1S/C10H22N2O.C4H9NO.CH4/c1-2-3-4-5-11-10-12-6-8-13-9-7-12;1-3-6-4-2-5-1;/h11H,2-10H2,1H3;5H,1-4H2;1H4
InChIKeyZIFHRHJLKMYUBW-UHFFFAOYSA-N
MW289.46 g/mol
LogP1.30
Rot. Bonds6

About methane;morpholine;N-(morpholin-4-ylmethyl)pentan-1-amine

methane;morpholine;N-(morpholin-4-ylmethyl)pentan-1-amine (PubChem CID 174432896) has the molecular formula C15H35N3O2 and a molecular weight of 289.46 g/mol. Its IUPAC name is methane;morpholine;N-(morpholin-4-ylmethyl)pentan-1-amine.

Molecular Properties

Compound Namemethane;morpholine;N-(morpholin-4-ylmethyl)pentan-1-amine
PubChem CID174432896
Molecular FormulaC15H35N3O2
Molecular Weight289.46 g/mol
Exact Mass289.27
IUPAC Namemethane;morpholine;N-(morpholin-4-ylmethyl)pentan-1-amine
SMILESC.C1COCCN1.CCCCCNCN1CCOCC1
InChIInChI=1S/C10H22N2O.C4H9NO.CH4/c1-2-3-4-5-11-10-12-6-8-13-9-7-12;1-3-6-4-2-5-1;/h11H,2-10H2,1H3;5H,1-4H2;1H4
InChIKeyZIFHRHJLKMYUBW-UHFFFAOYSA-N
XLogP1.30
TPSA45.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.46
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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 methane;morpholine;N-(morpholin-4-ylmethyl)pentan-1-amine?
The IUPAC name of methane;morpholine;N-(morpholin-4-ylmethyl)pentan-1-amine (CID 174432896) is methane;morpholine;N-(morpholin-4-ylmethyl)pentan-1-amine.
What is the SMILES notation for methane;morpholine;N-(morpholin-4-ylmethyl)pentan-1-amine?
The canonical SMILES for methane;morpholine;N-(morpholin-4-ylmethyl)pentan-1-amine is C.C1COCCN1.CCCCCNCN1CCOCC1.
What is the InChIKey of methane;morpholine;N-(morpholin-4-ylmethyl)pentan-1-amine?
The InChIKey is ZIFHRHJLKMYUBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O.C4H9NO.CH4/c1-2-3-4-5-11-10-12-6-8-13-9-7-12;1-3-6-4-2-5-1;/h11H,2-10H2,1H3;5H,1-4H2;1H4.
What are the key properties of methane;morpholine;N-(morpholin-4-ylmethyl)pentan-1-amine?
methane;morpholine;N-(morpholin-4-ylmethyl)pentan-1-amine has a molecular weight of 289.46 g/mol, XLogP of 1.30, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methane;morpholine;N-(morpholin-4-ylmethyl)pentan-1-amine is sourced from PubChem (CID 174432896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).