N-cyclopropyl-2-(2H-pyran-4-yl)acetamide

C10H13NO2 — CID 91807009

IUPACN-cyclopropyl-2-(2H-pyran-4-yl)acetamide
SMILESO=C(CC1=CCOC=C1)NC1CC1
InChIInChI=1S/C10H13NO2/c12-10(11-9-1-2-9)7-8-3-5-13-6-4-8/h3-5,9H,1-2,6-7H2,(H,11,12)
InChIKeyIWGMBUIHMPJXOH-UHFFFAOYSA-N
MW179.22 g/mol
LogP1.13
Rot. Bonds3

About N-cyclopropyl-2-(2H-pyran-4-yl)acetamide

N-cyclopropyl-2-(2H-pyran-4-yl)acetamide (PubChem CID 91807009) has the molecular formula C10H13NO2 and a molecular weight of 179.22 g/mol. Its IUPAC name is N-cyclopropyl-2-(2H-pyran-4-yl)acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(2H-pyran-4-yl)acetamide
PubChem CID91807009
Molecular FormulaC10H13NO2
Molecular Weight179.22 g/mol
Exact Mass179.09
IUPAC NameN-cyclopropyl-2-(2H-pyran-4-yl)acetamide
SMILESO=C(CC1=CCOC=C1)NC1CC1
InChIInChI=1S/C10H13NO2/c12-10(11-9-1-2-9)7-8-3-5-13-6-4-8/h3-5,9H,1-2,6-7H2,(H,11,12)
InChIKeyIWGMBUIHMPJXOH-UHFFFAOYSA-N
XLogP1.13
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(2H-pyran-4-yl)acetamide?
The IUPAC name of N-cyclopropyl-2-(2H-pyran-4-yl)acetamide (CID 91807009) is N-cyclopropyl-2-(2H-pyran-4-yl)acetamide.
What is the SMILES notation for N-cyclopropyl-2-(2H-pyran-4-yl)acetamide?
The canonical SMILES for N-cyclopropyl-2-(2H-pyran-4-yl)acetamide is O=C(CC1=CCOC=C1)NC1CC1.
What is the InChIKey of N-cyclopropyl-2-(2H-pyran-4-yl)acetamide?
The InChIKey is IWGMBUIHMPJXOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO2/c12-10(11-9-1-2-9)7-8-3-5-13-6-4-8/h3-5,9H,1-2,6-7H2,(H,11,12).
What are the key properties of N-cyclopropyl-2-(2H-pyran-4-yl)acetamide?
N-cyclopropyl-2-(2H-pyran-4-yl)acetamide has a molecular weight of 179.22 g/mol, XLogP of 1.13, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(2H-pyran-4-yl)acetamide is sourced from PubChem (CID 91807009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).