N-methyl-3-morpholin-4-ylpropanamide

C8H16N2O2 — CID 21035093

IUPACN-methyl-3-morpholin-4-ylpropanamide
SMILESCNC(=O)CCN1CCOCC1
InChIInChI=1S/C8H16N2O2/c1-9-8(11)2-3-10-4-6-12-7-5-10/h2-7H2,1H3,(H,9,11)
InChIKeyPPDBBEIMLYUYOA-UHFFFAOYSA-N
MW172.23 g/mol
LogP-0.55
Rot. Bonds3

About N-methyl-3-morpholin-4-ylpropanamide

N-methyl-3-morpholin-4-ylpropanamide (PubChem CID 21035093) has the molecular formula C8H16N2O2 and a molecular weight of 172.23 g/mol. Its IUPAC name is N-methyl-3-morpholin-4-ylpropanamide.

Molecular Properties

Compound NameN-methyl-3-morpholin-4-ylpropanamide
PubChem CID21035093
Molecular FormulaC8H16N2O2
Molecular Weight172.23 g/mol
Exact Mass172.12
IUPAC NameN-methyl-3-morpholin-4-ylpropanamide
SMILESCNC(=O)CCN1CCOCC1
InChIInChI=1S/C8H16N2O2/c1-9-8(11)2-3-10-4-6-12-7-5-10/h2-7H2,1H3,(H,9,11)
InChIKeyPPDBBEIMLYUYOA-UHFFFAOYSA-N
XLogP-0.55
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 5-0.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-3-morpholin-4-ylpropanamide?
The IUPAC name of N-methyl-3-morpholin-4-ylpropanamide (CID 21035093) is N-methyl-3-morpholin-4-ylpropanamide.
What is the SMILES notation for N-methyl-3-morpholin-4-ylpropanamide?
The canonical SMILES for N-methyl-3-morpholin-4-ylpropanamide is CNC(=O)CCN1CCOCC1.
What is the InChIKey of N-methyl-3-morpholin-4-ylpropanamide?
The InChIKey is PPDBBEIMLYUYOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O2/c1-9-8(11)2-3-10-4-6-12-7-5-10/h2-7H2,1H3,(H,9,11).
What are the key properties of N-methyl-3-morpholin-4-ylpropanamide?
N-methyl-3-morpholin-4-ylpropanamide has a molecular weight of 172.23 g/mol, XLogP of -0.55, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-morpholin-4-ylpropanamide is sourced from PubChem (CID 21035093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).