1-morpholin-4-yl-N-pentylmethanimine

C10H20N2O — CID 523952

IUPAC1-morpholin-4-yl-N-pentylmethanimine
SMILESCCCCC/N=C/N1CCOCC1
InChIInChI=1S/C10H20N2O/c1-2-3-4-5-11-10-12-6-8-13-9-7-12/h10H,2-9H2,1H3/b11-10+
InChIKeyIJEKILSIJKHXJU-ZHACJKMWSA-N
MW184.28 g/mol
LogP1.54
Rot. Bonds5

About 1-morpholin-4-yl-N-pentylmethanimine

1-morpholin-4-yl-N-pentylmethanimine (PubChem CID 523952) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 1-morpholin-4-yl-N-pentylmethanimine.

Molecular Properties

Compound Name1-morpholin-4-yl-N-pentylmethanimine
PubChem CID523952
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name1-morpholin-4-yl-N-pentylmethanimine
SMILESCCCCC/N=C/N1CCOCC1
InChIInChI=1S/C10H20N2O/c1-2-3-4-5-11-10-12-6-8-13-9-7-12/h10H,2-9H2,1H3/b11-10+
InChIKeyIJEKILSIJKHXJU-ZHACJKMWSA-N
XLogP1.54
TPSA24.83 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-morpholin-4-yl-N-pentylmethanimine?
The IUPAC name of 1-morpholin-4-yl-N-pentylmethanimine (CID 523952) is 1-morpholin-4-yl-N-pentylmethanimine.
What is the SMILES notation for 1-morpholin-4-yl-N-pentylmethanimine?
The canonical SMILES for 1-morpholin-4-yl-N-pentylmethanimine is CCCCC/N=C/N1CCOCC1.
What is the InChIKey of 1-morpholin-4-yl-N-pentylmethanimine?
The InChIKey is IJEKILSIJKHXJU-ZHACJKMWSA-N. The full InChI is InChI=1S/C10H20N2O/c1-2-3-4-5-11-10-12-6-8-13-9-7-12/h10H,2-9H2,1H3/b11-10+.
What are the key properties of 1-morpholin-4-yl-N-pentylmethanimine?
1-morpholin-4-yl-N-pentylmethanimine has a molecular weight of 184.28 g/mol, XLogP of 1.54, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-morpholin-4-yl-N-pentylmethanimine is sourced from PubChem (CID 523952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).