N-cyclopropyl-2-(3,6-dihydro-2H-pyran-5-ylmethylamino)acetamide

C11H18N2O2 — CID 127614588

IUPACN-cyclopropyl-2-(3,6-dihydro-2H-pyran-5-ylmethylamino)acetamide
SMILESO=C(CNCC1=CCCOC1)NC1CC1
InChIInChI=1S/C11H18N2O2/c14-11(13-10-3-4-10)7-12-6-9-2-1-5-15-8-9/h2,10,12H,1,3-8H2,(H,13,14)
InChIKeyUGODQRAWORZCRT-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.20
Rot. Bonds5

About N-cyclopropyl-2-(3,6-dihydro-2H-pyran-5-ylmethylamino)acetamide

N-cyclopropyl-2-(3,6-dihydro-2H-pyran-5-ylmethylamino)acetamide (PubChem CID 127614588) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is N-cyclopropyl-2-(3,6-dihydro-2H-pyran-5-ylmethylamino)acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(3,6-dihydro-2H-pyran-5-ylmethylamino)acetamide
PubChem CID127614588
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC NameN-cyclopropyl-2-(3,6-dihydro-2H-pyran-5-ylmethylamino)acetamide
SMILESO=C(CNCC1=CCCOC1)NC1CC1
InChIInChI=1S/C11H18N2O2/c14-11(13-10-3-4-10)7-12-6-9-2-1-5-15-8-9/h2,10,12H,1,3-8H2,(H,13,14)
InChIKeyUGODQRAWORZCRT-UHFFFAOYSA-N
XLogP0.20
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(3,6-dihydro-2H-pyran-5-ylmethylamino)acetamide?
The IUPAC name of N-cyclopropyl-2-(3,6-dihydro-2H-pyran-5-ylmethylamino)acetamide (CID 127614588) is N-cyclopropyl-2-(3,6-dihydro-2H-pyran-5-ylmethylamino)acetamide.
What is the SMILES notation for N-cyclopropyl-2-(3,6-dihydro-2H-pyran-5-ylmethylamino)acetamide?
The canonical SMILES for N-cyclopropyl-2-(3,6-dihydro-2H-pyran-5-ylmethylamino)acetamide is O=C(CNCC1=CCCOC1)NC1CC1.
What is the InChIKey of N-cyclopropyl-2-(3,6-dihydro-2H-pyran-5-ylmethylamino)acetamide?
The InChIKey is UGODQRAWORZCRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c14-11(13-10-3-4-10)7-12-6-9-2-1-5-15-8-9/h2,10,12H,1,3-8H2,(H,13,14).
What are the key properties of N-cyclopropyl-2-(3,6-dihydro-2H-pyran-5-ylmethylamino)acetamide?
N-cyclopropyl-2-(3,6-dihydro-2H-pyran-5-ylmethylamino)acetamide has a molecular weight of 210.28 g/mol, XLogP of 0.20, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(3,6-dihydro-2H-pyran-5-ylmethylamino)acetamide is sourced from PubChem (CID 127614588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).