N-[(2-methylpropan-2-yl)oxy]-1-(4-propan-2-ylmorpholin-2-yl)methanamine

C12H26N2O2 — CID 82723781

IUPACN-[(2-methylpropan-2-yl)oxy]-1-(4-propan-2-ylmorpholin-2-yl)methanamine
SMILESCC(C)N1CCOC(C1)CNOC(C)(C)C
InChIInChI=1S/C12H26N2O2/c1-10(2)14-6-7-15-11(9-14)8-13-16-12(3,4)5/h10-11,13H,6-9H2,1-5H3
InChIKeyFEMLNIQWTYVVNQ-UHFFFAOYSA-N
MW230.35 g/mol
LogP1.40
Rot. Bonds5

About N-[(2-methylpropan-2-yl)oxy]-1-(4-propan-2-ylmorpholin-2-yl)methanamine

N-[(2-methylpropan-2-yl)oxy]-1-(4-propan-2-ylmorpholin-2-yl)methanamine (PubChem CID 82723781) has the molecular formula C12H26N2O2 and a molecular weight of 230.35 g/mol. Its IUPAC name is N-[(2-methylpropan-2-yl)oxy]-1-(4-propan-2-ylmorpholin-2-yl)methanamine.

Molecular Properties

Compound NameN-[(2-methylpropan-2-yl)oxy]-1-(4-propan-2-ylmorpholin-2-yl)methanamine
PubChem CID82723781
Molecular FormulaC12H26N2O2
Molecular Weight230.35 g/mol
Exact Mass230.20
IUPAC NameN-[(2-methylpropan-2-yl)oxy]-1-(4-propan-2-ylmorpholin-2-yl)methanamine
SMILESCC(C)N1CCOC(C1)CNOC(C)(C)C
InChIInChI=1S/C12H26N2O2/c1-10(2)14-6-7-15-11(9-14)8-13-16-12(3,4)5/h10-11,13H,6-9H2,1-5H3
InChIKeyFEMLNIQWTYVVNQ-UHFFFAOYSA-N
XLogP1.40
TPSA33.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity202

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[(2-methylpropan-2-yl)oxy]-1-(4-propan-2-ylmorpholin-2-yl)methanamine?
The IUPAC name of N-[(2-methylpropan-2-yl)oxy]-1-(4-propan-2-ylmorpholin-2-yl)methanamine (CID 82723781) is N-[(2-methylpropan-2-yl)oxy]-1-(4-propan-2-ylmorpholin-2-yl)methanamine.
What is the SMILES notation for N-[(2-methylpropan-2-yl)oxy]-1-(4-propan-2-ylmorpholin-2-yl)methanamine?
The canonical SMILES for N-[(2-methylpropan-2-yl)oxy]-1-(4-propan-2-ylmorpholin-2-yl)methanamine is CC(C)N1CCOC(C1)CNOC(C)(C)C.
What is the InChIKey of N-[(2-methylpropan-2-yl)oxy]-1-(4-propan-2-ylmorpholin-2-yl)methanamine?
The InChIKey is FEMLNIQWTYVVNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2/c1-10(2)14-6-7-15-11(9-14)8-13-16-12(3,4)5/h10-11,13H,6-9H2,1-5H3.
What are the key properties of N-[(2-methylpropan-2-yl)oxy]-1-(4-propan-2-ylmorpholin-2-yl)methanamine?
N-[(2-methylpropan-2-yl)oxy]-1-(4-propan-2-ylmorpholin-2-yl)methanamine has a molecular weight of 230.35 g/mol, XLogP of 1.40, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylpropan-2-yl)oxy]-1-(4-propan-2-ylmorpholin-2-yl)methanamine is sourced from PubChem (CID 82723781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).