N-(4H-pyran-2-ylmethyl)acetamide

C8H11NO2 — CID 143705645

IUPACN-(4H-pyran-2-ylmethyl)acetamide
SMILESCC(=O)NCC1=CCC=CO1
InChIInChI=1S/C8H11NO2/c1-7(10)9-6-8-4-2-3-5-11-8/h3-5H,2,6H2,1H3,(H,9,10)
InChIKeyKRYILTJZJPHAEW-UHFFFAOYSA-N
MW153.18 g/mol
LogP0.94
Rot. Bonds2

About N-(4H-pyran-2-ylmethyl)acetamide

N-(4H-pyran-2-ylmethyl)acetamide (PubChem CID 143705645) has the molecular formula C8H11NO2 and a molecular weight of 153.18 g/mol. Its IUPAC name is N-(4H-pyran-2-ylmethyl)acetamide.

Molecular Properties

Compound NameN-(4H-pyran-2-ylmethyl)acetamide
PubChem CID143705645
Molecular FormulaC8H11NO2
Molecular Weight153.18 g/mol
Exact Mass153.08
IUPAC NameN-(4H-pyran-2-ylmethyl)acetamide
SMILESCC(=O)NCC1=CCC=CO1
InChIInChI=1S/C8H11NO2/c1-7(10)9-6-8-4-2-3-5-11-8/h3-5H,2,6H2,1H3,(H,9,10)
InChIKeyKRYILTJZJPHAEW-UHFFFAOYSA-N
XLogP0.94
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,2,2-trifluoro-N-(2-methyl-4H-pyran-4-yl)acetamide
CID 91807080
3-But-3-enoxy-1,2-dihydropyrrol-5-one
CID 19982567
(S)-4-Methoxy-5-methyl-1H-pyrrol-2(5H)-one
CID 10909584
N-(2,3-dihydrofuran-5-ylmethyl)-2-methylpropanamide
CID 89271436
N-(2,3-dihydrofuran-5-ylmethyl)propanamide
CID 89276987
(E)-N-(2-methoxyethyl)pent-2-enamide
CID 127125380
(E)-N-(2-methoxyethyl)-4-oxopent-2-enamide
CID 129091866
N-[2-[(Z)-prop-1-enoxy]prop-2-enyl]propanamide
CID 142133184
N-(3,4-dihydro-2H-pyran-6-ylmethyl)prop-2-enamide
CID 154236200
ethane;N-[(E)-pent-2-enyl]-2-propoxyacetamide
CID 154642916
(E)-N-(2-ethoxyethyl)-4-oxopent-2-enamide
CID 170359584
(Z)-N-(2-ethoxyethyl)-4-oxopent-2-enamide
CID 170359586

Frequently Asked Questions

What is the IUPAC name of N-(4H-pyran-2-ylmethyl)acetamide?
The IUPAC name of N-(4H-pyran-2-ylmethyl)acetamide (CID 143705645) is N-(4H-pyran-2-ylmethyl)acetamide.
What is the SMILES notation for N-(4H-pyran-2-ylmethyl)acetamide?
The canonical SMILES for N-(4H-pyran-2-ylmethyl)acetamide is CC(=O)NCC1=CCC=CO1.
What is the InChIKey of N-(4H-pyran-2-ylmethyl)acetamide?
The InChIKey is KRYILTJZJPHAEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO2/c1-7(10)9-6-8-4-2-3-5-11-8/h3-5H,2,6H2,1H3,(H,9,10).
What are the key properties of N-(4H-pyran-2-ylmethyl)acetamide?
N-(4H-pyran-2-ylmethyl)acetamide has a molecular weight of 153.18 g/mol, XLogP of 0.94, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4H-pyran-2-ylmethyl)acetamide is sourced from PubChem (CID 143705645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).