[4-[[4-(2-methylpropyl)morpholin-2-yl]methyl]morpholin-2-yl]methanamine

C14H29N3O2 — CID 114398613

IUPAC[4-[[4-(2-methylpropyl)morpholin-2-yl]methyl]morpholin-2-yl]methanamine
SMILESCC(C)CN1CCOC(CN2CCOC(CN)C2)C1
InChIInChI=1S/C14H29N3O2/c1-12(2)8-16-3-6-19-14(10-16)11-17-4-5-18-13(7-15)9-17/h12-14H,3-11,15H2,1-2H3
InChIKeyJDIITCJAOAFBGJ-UHFFFAOYSA-N
MW271.40 g/mol
LogP0.00
Rot. Bonds5

About [4-[[4-(2-methylpropyl)morpholin-2-yl]methyl]morpholin-2-yl]methanamine

[4-[[4-(2-methylpropyl)morpholin-2-yl]methyl]morpholin-2-yl]methanamine (PubChem CID 114398613) has the molecular formula C14H29N3O2 and a molecular weight of 271.40 g/mol. Its IUPAC name is [4-[[4-(2-methylpropyl)morpholin-2-yl]methyl]morpholin-2-yl]methanamine.

Molecular Properties

Compound Name[4-[[4-(2-methylpropyl)morpholin-2-yl]methyl]morpholin-2-yl]methanamine
PubChem CID114398613
Molecular FormulaC14H29N3O2
Molecular Weight271.40 g/mol
Exact Mass271.23
IUPAC Name[4-[[4-(2-methylpropyl)morpholin-2-yl]methyl]morpholin-2-yl]methanamine
SMILESCC(C)CN1CCOC(CN2CCOC(CN)C2)C1
InChIInChI=1S/C14H29N3O2/c1-12(2)8-16-3-6-19-14(10-16)11-17-4-5-18-13(7-15)9-17/h12-14H,3-11,15H2,1-2H3
InChIKeyJDIITCJAOAFBGJ-UHFFFAOYSA-N
XLogP0.00
TPSA50.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.40
LogP ≤ 50.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [4-[[4-(2-methylpropyl)morpholin-2-yl]methyl]morpholin-2-yl]methanamine?
The IUPAC name of [4-[[4-(2-methylpropyl)morpholin-2-yl]methyl]morpholin-2-yl]methanamine (CID 114398613) is [4-[[4-(2-methylpropyl)morpholin-2-yl]methyl]morpholin-2-yl]methanamine.
What is the SMILES notation for [4-[[4-(2-methylpropyl)morpholin-2-yl]methyl]morpholin-2-yl]methanamine?
The canonical SMILES for [4-[[4-(2-methylpropyl)morpholin-2-yl]methyl]morpholin-2-yl]methanamine is CC(C)CN1CCOC(CN2CCOC(CN)C2)C1.
What is the InChIKey of [4-[[4-(2-methylpropyl)morpholin-2-yl]methyl]morpholin-2-yl]methanamine?
The InChIKey is JDIITCJAOAFBGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O2/c1-12(2)8-16-3-6-19-14(10-16)11-17-4-5-18-13(7-15)9-17/h12-14H,3-11,15H2,1-2H3.
What are the key properties of [4-[[4-(2-methylpropyl)morpholin-2-yl]methyl]morpholin-2-yl]methanamine?
[4-[[4-(2-methylpropyl)morpholin-2-yl]methyl]morpholin-2-yl]methanamine has a molecular weight of 271.40 g/mol, XLogP of 0.00, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[[4-(2-methylpropyl)morpholin-2-yl]methyl]morpholin-2-yl]methanamine is sourced from PubChem (CID 114398613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).