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

C9H15NO3 — CID 130694220

IUPACN-(2-hydroxypropyl)-3,4-dihydro-2H-pyran-2-carboxamide
SMILESCC(O)CNC(=O)C1CCC=CO1
InChIInChI=1S/C9H15NO3/c1-7(11)6-10-9(12)8-4-2-3-5-13-8/h3,5,7-8,11H,2,4,6H2,1H3,(H,10,12)
InChIKeyNNDHRNFDIKJCOU-UHFFFAOYSA-N
MW185.22 g/mol
LogP0.18
Rot. Bonds3

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

N-(2-hydroxypropyl)-3,4-dihydro-2H-pyran-2-carboxamide (PubChem CID 130694220) 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-2-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxypropyl)-3,4-dihydro-2H-pyran-2-carboxamide
PubChem CID130694220
Molecular FormulaC9H15NO3
Molecular Weight185.22 g/mol
Exact Mass185.11
IUPAC NameN-(2-hydroxypropyl)-3,4-dihydro-2H-pyran-2-carboxamide
SMILESCC(O)CNC(=O)C1CCC=CO1
InChIInChI=1S/C9H15NO3/c1-7(11)6-10-9(12)8-4-2-3-5-13-8/h3,5,7-8,11H,2,4,6H2,1H3,(H,10,12)
InChIKeyNNDHRNFDIKJCOU-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

N-(2-fluoroethyl)-3,4-dihydro-2H-pyran-2-carboxamide
CID 126996521
N-methyl-3,4-dihydro-2H-pyran-2-carboxamide
CID 131225571
N,N-diethyl-3,4-dihydro-2H-pyran-2-carboxamide
CID 141178157
N-(2-hydroxyethyl)-2,3-dihydrofuran-2-carboxamide
CID 142271078
3-(3,4-dihydro-2H-pyran-2-ylmethylamino)-2-hydroxypropanamide
CID 106171617
N-[(1S)-1-cyanoethyl]-3,4-dihydro-2H-pyran-2-carboxamide
CID 126987464
N-propan-2-yl-3,4-dihydro-2H-pyran-2-carboxamide
CID 127012090
N-prop-2-enyl-3,4-dihydro-2H-pyran-2-carboxamide
CID 130635445
N-(2-chloroprop-2-enyl)-3,4-dihydro-2H-pyran-2-carboxamide
CID 130662803
N-(2-methylprop-2-enyl)-3,4-dihydro-2H-pyran-2-carboxamide
CID 130684849
N-(2-cyanoethyl)-3,4-dihydro-2H-pyran-2-carboxamide
CID 130723793
N-(1-cyanoethyl)-3,4-dihydro-2H-pyran-2-carboxamide
CID 130725490

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxypropyl)-3,4-dihydro-2H-pyran-2-carboxamide?
The IUPAC name of N-(2-hydroxypropyl)-3,4-dihydro-2H-pyran-2-carboxamide (CID 130694220) is N-(2-hydroxypropyl)-3,4-dihydro-2H-pyran-2-carboxamide.
What is the SMILES notation for N-(2-hydroxypropyl)-3,4-dihydro-2H-pyran-2-carboxamide?
The canonical SMILES for N-(2-hydroxypropyl)-3,4-dihydro-2H-pyran-2-carboxamide is CC(O)CNC(=O)C1CCC=CO1.
What is the InChIKey of N-(2-hydroxypropyl)-3,4-dihydro-2H-pyran-2-carboxamide?
The InChIKey is NNDHRNFDIKJCOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO3/c1-7(11)6-10-9(12)8-4-2-3-5-13-8/h3,5,7-8,11H,2,4,6H2,1H3,(H,10,12).
What are the key properties of N-(2-hydroxypropyl)-3,4-dihydro-2H-pyran-2-carboxamide?
N-(2-hydroxypropyl)-3,4-dihydro-2H-pyran-2-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-2-carboxamide is sourced from PubChem (CID 130694220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).