N-(3-morpholin-4-ylpropyl)prop-2-enamide

C10H18N2O2 — CID 11735756

IUPACN-(3-morpholin-4-ylpropyl)prop-2-enamide
SMILESC=CC(=O)NCCCN1CCOCC1
InChIInChI=1S/C10H18N2O2/c1-2-10(13)11-4-3-5-12-6-8-14-9-7-12/h2H,1,3-9H2,(H,11,13)
InChIKeyOSVIOFVAMHTXBO-UHFFFAOYSA-N
MW198.27 g/mol
LogP0.01
Rot. Bonds5

About N-(3-morpholin-4-ylpropyl)prop-2-enamide

N-(3-morpholin-4-ylpropyl)prop-2-enamide (PubChem CID 11735756) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is N-(3-morpholin-4-ylpropyl)prop-2-enamide.

Molecular Properties

Compound NameN-(3-morpholin-4-ylpropyl)prop-2-enamide
PubChem CID11735756
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC NameN-(3-morpholin-4-ylpropyl)prop-2-enamide
SMILESC=CC(=O)NCCCN1CCOCC1
InChIInChI=1S/C10H18N2O2/c1-2-10(13)11-4-3-5-12-6-8-14-9-7-12/h2H,1,3-9H2,(H,11,13)
InChIKeyOSVIOFVAMHTXBO-UHFFFAOYSA-N
XLogP0.01
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 50.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(3-morpholin-4-ylpropyl)prop-2-enamide?
The IUPAC name of N-(3-morpholin-4-ylpropyl)prop-2-enamide (CID 11735756) is N-(3-morpholin-4-ylpropyl)prop-2-enamide.
What is the SMILES notation for N-(3-morpholin-4-ylpropyl)prop-2-enamide?
The canonical SMILES for N-(3-morpholin-4-ylpropyl)prop-2-enamide is C=CC(=O)NCCCN1CCOCC1.
What is the InChIKey of N-(3-morpholin-4-ylpropyl)prop-2-enamide?
The InChIKey is OSVIOFVAMHTXBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2/c1-2-10(13)11-4-3-5-12-6-8-14-9-7-12/h2H,1,3-9H2,(H,11,13).
What are the key properties of N-(3-morpholin-4-ylpropyl)prop-2-enamide?
N-(3-morpholin-4-ylpropyl)prop-2-enamide has a molecular weight of 198.27 g/mol, XLogP of 0.01, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-morpholin-4-ylpropyl)prop-2-enamide is sourced from PubChem (CID 11735756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).