2-(morpholin-4-ylmethyl)prop-2-enamide

C8H14N2O2 — CID 67365699

IUPAC2-(morpholin-4-ylmethyl)prop-2-enamide
SMILESC=C(CN1CCOCC1)C(N)=O
InChIInChI=1S/C8H14N2O2/c1-7(8(9)11)6-10-2-4-12-5-3-10/h1-6H2,(H2,9,11)
InChIKeyMKGOGSOKYNZCCE-UHFFFAOYSA-N
MW170.21 g/mol
LogP-0.64
Rot. Bonds3

About 2-(morpholin-4-ylmethyl)prop-2-enamide

2-(morpholin-4-ylmethyl)prop-2-enamide (PubChem CID 67365699) has the molecular formula C8H14N2O2 and a molecular weight of 170.21 g/mol. Its IUPAC name is 2-(morpholin-4-ylmethyl)prop-2-enamide.

Molecular Properties

Compound Name2-(morpholin-4-ylmethyl)prop-2-enamide
PubChem CID67365699
Molecular FormulaC8H14N2O2
Molecular Weight170.21 g/mol
Exact Mass170.11
IUPAC Name2-(morpholin-4-ylmethyl)prop-2-enamide
SMILESC=C(CN1CCOCC1)C(N)=O
InChIInChI=1S/C8H14N2O2/c1-7(8(9)11)6-10-2-4-12-5-3-10/h1-6H2,(H2,9,11)
InChIKeyMKGOGSOKYNZCCE-UHFFFAOYSA-N
XLogP-0.64
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.21
LogP ≤ 5-0.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(morpholin-4-ylmethyl)prop-2-enamide?
The IUPAC name of 2-(morpholin-4-ylmethyl)prop-2-enamide (CID 67365699) is 2-(morpholin-4-ylmethyl)prop-2-enamide.
What is the SMILES notation for 2-(morpholin-4-ylmethyl)prop-2-enamide?
The canonical SMILES for 2-(morpholin-4-ylmethyl)prop-2-enamide is C=C(CN1CCOCC1)C(N)=O.
What is the InChIKey of 2-(morpholin-4-ylmethyl)prop-2-enamide?
The InChIKey is MKGOGSOKYNZCCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O2/c1-7(8(9)11)6-10-2-4-12-5-3-10/h1-6H2,(H2,9,11).
What are the key properties of 2-(morpholin-4-ylmethyl)prop-2-enamide?
2-(morpholin-4-ylmethyl)prop-2-enamide has a molecular weight of 170.21 g/mol, XLogP of -0.64, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(morpholin-4-ylmethyl)prop-2-enamide is sourced from PubChem (CID 67365699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).