N-(1-methylcyclopropyl)-3,6-dihydro-2H-pyran-4-carboxamide

C10H15NO2 — CID 127012104

IUPACN-(1-methylcyclopropyl)-3,6-dihydro-2H-pyran-4-carboxamide
SMILESCC1(NC(=O)C2=CCOCC2)CC1
InChIInChI=1S/C10H15NO2/c1-10(4-5-10)11-9(12)8-2-6-13-7-3-8/h2H,3-7H2,1H3,(H,11,12)
InChIKeyMGNQDMVKHLOYGB-UHFFFAOYSA-N
MW181.23 g/mol
LogP1.00
Rot. Bonds2

About N-(1-methylcyclopropyl)-3,6-dihydro-2H-pyran-4-carboxamide

N-(1-methylcyclopropyl)-3,6-dihydro-2H-pyran-4-carboxamide (PubChem CID 127012104) has the molecular formula C10H15NO2 and a molecular weight of 181.23 g/mol. Its IUPAC name is N-(1-methylcyclopropyl)-3,6-dihydro-2H-pyran-4-carboxamide.

Molecular Properties

Compound NameN-(1-methylcyclopropyl)-3,6-dihydro-2H-pyran-4-carboxamide
PubChem CID127012104
Molecular FormulaC10H15NO2
Molecular Weight181.23 g/mol
Exact Mass181.11
IUPAC NameN-(1-methylcyclopropyl)-3,6-dihydro-2H-pyran-4-carboxamide
SMILESCC1(NC(=O)C2=CCOCC2)CC1
InChIInChI=1S/C10H15NO2/c1-10(4-5-10)11-9(12)8-2-6-13-7-3-8/h2H,3-7H2,1H3,(H,11,12)
InChIKeyMGNQDMVKHLOYGB-UHFFFAOYSA-N
XLogP1.00
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.23
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1-methylcyclopropyl)-3,6-dihydro-2H-pyran-4-carboxamide?
The IUPAC name of N-(1-methylcyclopropyl)-3,6-dihydro-2H-pyran-4-carboxamide (CID 127012104) is N-(1-methylcyclopropyl)-3,6-dihydro-2H-pyran-4-carboxamide.
What is the SMILES notation for N-(1-methylcyclopropyl)-3,6-dihydro-2H-pyran-4-carboxamide?
The canonical SMILES for N-(1-methylcyclopropyl)-3,6-dihydro-2H-pyran-4-carboxamide is CC1(NC(=O)C2=CCOCC2)CC1.
What is the InChIKey of N-(1-methylcyclopropyl)-3,6-dihydro-2H-pyran-4-carboxamide?
The InChIKey is MGNQDMVKHLOYGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2/c1-10(4-5-10)11-9(12)8-2-6-13-7-3-8/h2H,3-7H2,1H3,(H,11,12).
What are the key properties of N-(1-methylcyclopropyl)-3,6-dihydro-2H-pyran-4-carboxamide?
N-(1-methylcyclopropyl)-3,6-dihydro-2H-pyran-4-carboxamide has a molecular weight of 181.23 g/mol, XLogP of 1.00, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methylcyclopropyl)-3,6-dihydro-2H-pyran-4-carboxamide is sourced from PubChem (CID 127012104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).