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

C9H15NO3 — CID 130666759

IUPACN-(2-hydroxypropyl)-3,4-dihydro-2H-pyran-6-carboxamide
SMILESCC(O)CNC(=O)C1=CCCCO1
InChIInChI=1S/C9H15NO3/c1-7(11)6-10-9(12)8-4-2-3-5-13-8/h4,7,11H,2-3,5-6H2,1H3,(H,10,12)
InChIKeyJKYQAZMTSZDSIE-UHFFFAOYSA-N
MW185.22 g/mol
LogP0.18
Rot. Bonds3

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

N-(2-hydroxypropyl)-3,4-dihydro-2H-pyran-6-carboxamide (PubChem CID 130666759) has the molecular formula C9H15NO3 and a molecular weight of 185.22 g/mol. Its IUPAC name is N-(2-hydroxypropyl)-3,4-dihydro-2H-pyran-6-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxypropyl)-3,4-dihydro-2H-pyran-6-carboxamide
PubChem CID130666759
Molecular FormulaC9H15NO3
Molecular Weight185.22 g/mol
Exact Mass185.11
IUPAC NameN-(2-hydroxypropyl)-3,4-dihydro-2H-pyran-6-carboxamide
SMILESCC(O)CNC(=O)C1=CCCCO1
InChIInChI=1S/C9H15NO3/c1-7(11)6-10-9(12)8-4-2-3-5-13-8/h4,7,11H,2-3,5-6H2,1H3,(H,10,12)
InChIKeyJKYQAZMTSZDSIE-UHFFFAOYSA-N
XLogP0.18
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.22
LogP ≤ 50.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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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-hydroxy-4-oxo-N-propylpyran-2-carboxamide
CID 143761978
N-ethyl-2-methyl-2,3-dihydrofuran-5-carboxamide
CID 164015740
5-methoxy-2,3-dihydro-1H-pyridin-6-one
CID 14991076
(2R,3S)-3-hydroxy-5-methoxy-2-methyl-2,3-dihydro-1H-pyridin-6-one
CID 45083225
5-methoxy-4-oxo-N-propyl-4H-pyran-2-carboxamide
CID 45537834
3-hydroxy-5-methoxy-2-methyl-2,3-dihydro-1H-pyridin-6-one
CID 71437504
N-[4-(2,6-dimethylmorpholin-4-yl)butyl]-3,4-dihydro-2H-pyran-6-carboxamide
CID 71973242
N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]butyl]-3,4-dihydro-2H-pyran-6-carboxamide
CID 97039142
N-[4-[(2S,6S)-2,6-dimethylmorpholin-4-yl]butyl]-3,4-dihydro-2H-pyran-6-carboxamide
CID 97039143

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxypropyl)-3,4-dihydro-2H-pyran-6-carboxamide?
The IUPAC name of N-(2-hydroxypropyl)-3,4-dihydro-2H-pyran-6-carboxamide (CID 130666759) is N-(2-hydroxypropyl)-3,4-dihydro-2H-pyran-6-carboxamide.
What is the SMILES notation for N-(2-hydroxypropyl)-3,4-dihydro-2H-pyran-6-carboxamide?
The canonical SMILES for N-(2-hydroxypropyl)-3,4-dihydro-2H-pyran-6-carboxamide is CC(O)CNC(=O)C1=CCCCO1.
What is the InChIKey of N-(2-hydroxypropyl)-3,4-dihydro-2H-pyran-6-carboxamide?
The InChIKey is JKYQAZMTSZDSIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO3/c1-7(11)6-10-9(12)8-4-2-3-5-13-8/h4,7,11H,2-3,5-6H2,1H3,(H,10,12).
What are the key properties of N-(2-hydroxypropyl)-3,4-dihydro-2H-pyran-6-carboxamide?
N-(2-hydroxypropyl)-3,4-dihydro-2H-pyran-6-carboxamide has a molecular weight of 185.22 g/mol, XLogP of 0.18, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxypropyl)-3,4-dihydro-2H-pyran-6-carboxamide is sourced from PubChem (CID 130666759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).