(4-dodecylmorpholin-2-yl)methanamine

C17H36N2O — CID 63486829

IUPAC(4-dodecylmorpholin-2-yl)methanamine
SMILESCCCCCCCCCCCCN1CCOC(CN)C1
InChIInChI=1S/C17H36N2O/c1-2-3-4-5-6-7-8-9-10-11-12-19-13-14-20-17(15-18)16-19/h17H,2-16,18H2,1H3
InChIKeyPIYLWPBGULRMDF-UHFFFAOYSA-N
MW284.49 g/mol
LogP3.57
Rot. Bonds12

About (4-dodecylmorpholin-2-yl)methanamine

(4-dodecylmorpholin-2-yl)methanamine (PubChem CID 63486829) has the molecular formula C17H36N2O and a molecular weight of 284.49 g/mol. Its IUPAC name is (4-dodecylmorpholin-2-yl)methanamine.

Molecular Properties

Compound Name(4-dodecylmorpholin-2-yl)methanamine
PubChem CID63486829
Molecular FormulaC17H36N2O
Molecular Weight284.49 g/mol
Exact Mass284.28
IUPAC Name(4-dodecylmorpholin-2-yl)methanamine
SMILESCCCCCCCCCCCCN1CCOC(CN)C1
InChIInChI=1S/C17H36N2O/c1-2-3-4-5-6-7-8-9-10-11-12-19-13-14-20-17(15-18)16-19/h17H,2-16,18H2,1H3
InChIKeyPIYLWPBGULRMDF-UHFFFAOYSA-N
XLogP3.57
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.49
LogP ≤ 53.57
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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Related Compounds

4-dodecyl-2-ethylmorpholine
CID 4616518
(2S)-2-butyl-4-decylmorpholine
CID 98152093
2-(chloromethyl)-4-heptylmorpholine
CID 81213546
2-(chloromethyl)-4-pentylmorpholine
CID 81213679
[4-(4-methylpentyl)morpholin-2-yl]methanamine
CID 83157184
[4-(3-ethylsulfanylpropyl)morpholin-2-yl]methanamine
CID 114395168
4-[2-(aminomethyl)morpholin-4-yl]-N,N-diethylbutanamide
CID 114398814
methyl 4-[2-(aminomethyl)morpholin-4-yl]butanoate
CID 114398668
6-[2-(aminomethyl)morpholin-4-yl]-2,2-dimethylhexanenitrile
CID 106713456
2-benzyl-4-dodecylmorpholine
CID 70634633
2-[2-(aminomethyl)morpholin-4-yl]-N-butylacetamide
CID 61485522
azane;4-dodecyl-2-methylmorpholine;hydrobromide
CID 174921468

Frequently Asked Questions

What is the IUPAC name of (4-dodecylmorpholin-2-yl)methanamine?
The IUPAC name of (4-dodecylmorpholin-2-yl)methanamine (CID 63486829) is (4-dodecylmorpholin-2-yl)methanamine.
What is the SMILES notation for (4-dodecylmorpholin-2-yl)methanamine?
The canonical SMILES for (4-dodecylmorpholin-2-yl)methanamine is CCCCCCCCCCCCN1CCOC(CN)C1.
What is the InChIKey of (4-dodecylmorpholin-2-yl)methanamine?
The InChIKey is PIYLWPBGULRMDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H36N2O/c1-2-3-4-5-6-7-8-9-10-11-12-19-13-14-20-17(15-18)16-19/h17H,2-16,18H2,1H3.
What are the key properties of (4-dodecylmorpholin-2-yl)methanamine?
(4-dodecylmorpholin-2-yl)methanamine has a molecular weight of 284.49 g/mol, XLogP of 3.57, 12 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-dodecylmorpholin-2-yl)methanamine is sourced from PubChem (CID 63486829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).