N-methyl-1-[4-(2-propan-2-yloxyethyl)morpholin-3-yl]methanamine

C11H24N2O2 — CID 83100152

IUPACN-methyl-1-[4-(2-propan-2-yloxyethyl)morpholin-3-yl]methanamine
SMILESCNCC1COCCN1CCOC(C)C
InChIInChI=1S/C11H24N2O2/c1-10(2)15-7-5-13-4-6-14-9-11(13)8-12-3/h10-12H,4-9H2,1-3H3
InChIKeyKILYYQJNDBVUBB-UHFFFAOYSA-N
MW216.32 g/mol
LogP0.33
Rot. Bonds6

About N-methyl-1-[4-(2-propan-2-yloxyethyl)morpholin-3-yl]methanamine

N-methyl-1-[4-(2-propan-2-yloxyethyl)morpholin-3-yl]methanamine (PubChem CID 83100152) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is N-methyl-1-[4-(2-propan-2-yloxyethyl)morpholin-3-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[4-(2-propan-2-yloxyethyl)morpholin-3-yl]methanamine
PubChem CID83100152
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC NameN-methyl-1-[4-(2-propan-2-yloxyethyl)morpholin-3-yl]methanamine
SMILESCNCC1COCCN1CCOC(C)C
InChIInChI=1S/C11H24N2O2/c1-10(2)15-7-5-13-4-6-14-9-11(13)8-12-3/h10-12H,4-9H2,1-3H3
InChIKeyKILYYQJNDBVUBB-UHFFFAOYSA-N
XLogP0.33
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 50.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[4-(2-propan-2-yloxyethyl)morpholin-3-yl]methanamine?
The IUPAC name of N-methyl-1-[4-(2-propan-2-yloxyethyl)morpholin-3-yl]methanamine (CID 83100152) is N-methyl-1-[4-(2-propan-2-yloxyethyl)morpholin-3-yl]methanamine.
What is the SMILES notation for N-methyl-1-[4-(2-propan-2-yloxyethyl)morpholin-3-yl]methanamine?
The canonical SMILES for N-methyl-1-[4-(2-propan-2-yloxyethyl)morpholin-3-yl]methanamine is CNCC1COCCN1CCOC(C)C.
What is the InChIKey of N-methyl-1-[4-(2-propan-2-yloxyethyl)morpholin-3-yl]methanamine?
The InChIKey is KILYYQJNDBVUBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-10(2)15-7-5-13-4-6-14-9-11(13)8-12-3/h10-12H,4-9H2,1-3H3.
What are the key properties of N-methyl-1-[4-(2-propan-2-yloxyethyl)morpholin-3-yl]methanamine?
N-methyl-1-[4-(2-propan-2-yloxyethyl)morpholin-3-yl]methanamine has a molecular weight of 216.32 g/mol, XLogP of 0.33, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[4-(2-propan-2-yloxyethyl)morpholin-3-yl]methanamine is sourced from PubChem (CID 83100152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).