N-(2-methylprop-2-enyl)-3,4-dihydro-2H-pyran-6-carboxamide

C10H15NO2 — CID 130611407

IUPACN-(2-methylprop-2-enyl)-3,4-dihydro-2H-pyran-6-carboxamide
SMILESC=C(C)CNC(=O)C1=CCCCO1
InChIInChI=1S/C10H15NO2/c1-8(2)7-11-10(12)9-5-3-4-6-13-9/h5H,1,3-4,6-7H2,2H3,(H,11,12)
InChIKeyGAULAMLFLWGZBZ-UHFFFAOYSA-N
MW181.23 g/mol
LogP1.37
Rot. Bonds3

About N-(2-methylprop-2-enyl)-3,4-dihydro-2H-pyran-6-carboxamide

N-(2-methylprop-2-enyl)-3,4-dihydro-2H-pyran-6-carboxamide (PubChem CID 130611407) has the molecular formula C10H15NO2 and a molecular weight of 181.23 g/mol. Its IUPAC name is N-(2-methylprop-2-enyl)-3,4-dihydro-2H-pyran-6-carboxamide.

Molecular Properties

Compound NameN-(2-methylprop-2-enyl)-3,4-dihydro-2H-pyran-6-carboxamide
PubChem CID130611407
Molecular FormulaC10H15NO2
Molecular Weight181.23 g/mol
Exact Mass181.11
IUPAC NameN-(2-methylprop-2-enyl)-3,4-dihydro-2H-pyran-6-carboxamide
SMILESC=C(C)CNC(=O)C1=CCCCO1
InChIInChI=1S/C10H15NO2/c1-8(2)7-11-10(12)9-5-3-4-6-13-9/h5H,1,3-4,6-7H2,2H3,(H,11,12)
InChIKeyGAULAMLFLWGZBZ-UHFFFAOYSA-N
XLogP1.37
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.23
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

6-Methyl-3-ethoxy-5,6-dihydro-2-pyridinol
CID 134612800
N-(2-fluoroethyl)-3,4-dihydro-2H-pyran-6-carboxamide
CID 127017391
N-(1-fluoropropan-2-yl)-3,4-dihydro-2H-pyran-6-carboxamide
CID 130708560
3-butoxy-N-butyl-6-methyl-4-oxopyran-2-carboxamide
CID 89390543
(6E)-5-ethyl-6-ethylidenemorpholin-3-one
CID 144082939
N-(3,4-dihydro-2H-pyran-6-ylmethyl)prop-2-enamide
CID 154236200
N-ethyl-2-methyl-2,3-dihydrofuran-5-carboxamide
CID 164015740
5-methoxy-2,3-dihydro-1H-pyridin-6-one
CID 14991076
5-methoxy-4-oxo-N-propyl-4H-pyran-2-carboxamide
CID 45537834
N-isobutyl-5-methoxy-4-oxo-4H-pyran-2-carboxamide
CID 45537837
N,3-dimethyl-4-oxopyran-2-carboxamide
CID 59227363
N-[(2S)-2-methoxy-3-methylbutyl]-3,4-dihydro-2H-pyran-6-carboxamide
CID 99813218

Frequently Asked Questions

What is the IUPAC name of N-(2-methylprop-2-enyl)-3,4-dihydro-2H-pyran-6-carboxamide?
The IUPAC name of N-(2-methylprop-2-enyl)-3,4-dihydro-2H-pyran-6-carboxamide (CID 130611407) is N-(2-methylprop-2-enyl)-3,4-dihydro-2H-pyran-6-carboxamide.
What is the SMILES notation for N-(2-methylprop-2-enyl)-3,4-dihydro-2H-pyran-6-carboxamide?
The canonical SMILES for N-(2-methylprop-2-enyl)-3,4-dihydro-2H-pyran-6-carboxamide is C=C(C)CNC(=O)C1=CCCCO1.
What is the InChIKey of N-(2-methylprop-2-enyl)-3,4-dihydro-2H-pyran-6-carboxamide?
The InChIKey is GAULAMLFLWGZBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2/c1-8(2)7-11-10(12)9-5-3-4-6-13-9/h5H,1,3-4,6-7H2,2H3,(H,11,12).
What are the key properties of N-(2-methylprop-2-enyl)-3,4-dihydro-2H-pyran-6-carboxamide?
N-(2-methylprop-2-enyl)-3,4-dihydro-2H-pyran-6-carboxamide has a molecular weight of 181.23 g/mol, XLogP of 1.37, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylprop-2-enyl)-3,4-dihydro-2H-pyran-6-carboxamide is sourced from PubChem (CID 130611407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).