N-methyl-N-[(5-methyl-1H-imidazol-2-yl)methyl]-2-morpholin-4-ylacetamide

C12H20N4O2 — CID 86284829

IUPACN-methyl-N-[(5-methyl-1H-imidazol-2-yl)methyl]-2-morpholin-4-ylacetamide
SMILESCc1cnc(CN(C)C(=O)CN2CCOCC2)[nH]1
InChIInChI=1S/C12H20N4O2/c1-10-7-13-11(14-10)8-15(2)12(17)9-16-3-5-18-6-4-16/h7H,3-6,8-9H2,1-2H3,(H,13,14)
InChIKeyBDIUIJQOVKSVDA-UHFFFAOYSA-N
MW252.32 g/mol
LogP0.01
Rot. Bonds4

About N-methyl-N-[(5-methyl-1H-imidazol-2-yl)methyl]-2-morpholin-4-ylacetamide

N-methyl-N-[(5-methyl-1H-imidazol-2-yl)methyl]-2-morpholin-4-ylacetamide (PubChem CID 86284829) has the molecular formula C12H20N4O2 and a molecular weight of 252.32 g/mol. Its IUPAC name is N-methyl-N-[(5-methyl-1H-imidazol-2-yl)methyl]-2-morpholin-4-ylacetamide.

Molecular Properties

Compound NameN-methyl-N-[(5-methyl-1H-imidazol-2-yl)methyl]-2-morpholin-4-ylacetamide
PubChem CID86284829
Molecular FormulaC12H20N4O2
Molecular Weight252.32 g/mol
Exact Mass252.16
IUPAC NameN-methyl-N-[(5-methyl-1H-imidazol-2-yl)methyl]-2-morpholin-4-ylacetamide
SMILESCc1cnc(CN(C)C(=O)CN2CCOCC2)[nH]1
InChIInChI=1S/C12H20N4O2/c1-10-7-13-11(14-10)8-15(2)12(17)9-16-3-5-18-6-4-16/h7H,3-6,8-9H2,1-2H3,(H,13,14)
InChIKeyBDIUIJQOVKSVDA-UHFFFAOYSA-N
XLogP0.01
TPSA61.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 50.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(5-methyl-1H-imidazol-2-yl)methyl]-2-morpholin-4-ylacetamide?
The IUPAC name of N-methyl-N-[(5-methyl-1H-imidazol-2-yl)methyl]-2-morpholin-4-ylacetamide (CID 86284829) is N-methyl-N-[(5-methyl-1H-imidazol-2-yl)methyl]-2-morpholin-4-ylacetamide.
What is the SMILES notation for N-methyl-N-[(5-methyl-1H-imidazol-2-yl)methyl]-2-morpholin-4-ylacetamide?
The canonical SMILES for N-methyl-N-[(5-methyl-1H-imidazol-2-yl)methyl]-2-morpholin-4-ylacetamide is Cc1cnc(CN(C)C(=O)CN2CCOCC2)[nH]1.
What is the InChIKey of N-methyl-N-[(5-methyl-1H-imidazol-2-yl)methyl]-2-morpholin-4-ylacetamide?
The InChIKey is BDIUIJQOVKSVDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O2/c1-10-7-13-11(14-10)8-15(2)12(17)9-16-3-5-18-6-4-16/h7H,3-6,8-9H2,1-2H3,(H,13,14).
What are the key properties of N-methyl-N-[(5-methyl-1H-imidazol-2-yl)methyl]-2-morpholin-4-ylacetamide?
N-methyl-N-[(5-methyl-1H-imidazol-2-yl)methyl]-2-morpholin-4-ylacetamide has a molecular weight of 252.32 g/mol, XLogP of 0.01, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(5-methyl-1H-imidazol-2-yl)methyl]-2-morpholin-4-ylacetamide is sourced from PubChem (CID 86284829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).