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

C11H17NO3 — CID 99776373

IUPACN-cyclopropyl-N-(2-hydroxyethyl)-3,4-dihydro-2H-pyran-6-carboxamide
SMILESO=C(C1=CCCCO1)N(CCO)C1CC1
InChIInChI=1S/C11H17NO3/c13-7-6-12(9-4-5-9)11(14)10-3-1-2-8-15-10/h3,9,13H,1-2,4-8H2
InChIKeyYNLCCLKNVXVBLK-UHFFFAOYSA-N
MW211.26 g/mol
LogP0.66
Rot. Bonds4

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

N-cyclopropyl-N-(2-hydroxyethyl)-3,4-dihydro-2H-pyran-6-carboxamide (PubChem CID 99776373) has the molecular formula C11H17NO3 and a molecular weight of 211.26 g/mol. Its IUPAC name is N-cyclopropyl-N-(2-hydroxyethyl)-3,4-dihydro-2H-pyran-6-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-N-(2-hydroxyethyl)-3,4-dihydro-2H-pyran-6-carboxamide
PubChem CID99776373
Molecular FormulaC11H17NO3
Molecular Weight211.26 g/mol
Exact Mass211.12
IUPAC NameN-cyclopropyl-N-(2-hydroxyethyl)-3,4-dihydro-2H-pyran-6-carboxamide
SMILESO=C(C1=CCCCO1)N(CCO)C1CC1
InChIInChI=1S/C11H17NO3/c13-7-6-12(9-4-5-9)11(14)10-3-1-2-8-15-10/h3,9,13H,1-2,4-8H2
InChIKeyYNLCCLKNVXVBLK-UHFFFAOYSA-N
XLogP0.66
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 50.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(2-hydroxyethyl)-3,4-dihydro-2H-pyran-6-carboxamide?
The IUPAC name of N-cyclopropyl-N-(2-hydroxyethyl)-3,4-dihydro-2H-pyran-6-carboxamide (CID 99776373) is N-cyclopropyl-N-(2-hydroxyethyl)-3,4-dihydro-2H-pyran-6-carboxamide.
What is the SMILES notation for N-cyclopropyl-N-(2-hydroxyethyl)-3,4-dihydro-2H-pyran-6-carboxamide?
The canonical SMILES for N-cyclopropyl-N-(2-hydroxyethyl)-3,4-dihydro-2H-pyran-6-carboxamide is O=C(C1=CCCCO1)N(CCO)C1CC1.
What is the InChIKey of N-cyclopropyl-N-(2-hydroxyethyl)-3,4-dihydro-2H-pyran-6-carboxamide?
The InChIKey is YNLCCLKNVXVBLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO3/c13-7-6-12(9-4-5-9)11(14)10-3-1-2-8-15-10/h3,9,13H,1-2,4-8H2.
What are the key properties of N-cyclopropyl-N-(2-hydroxyethyl)-3,4-dihydro-2H-pyran-6-carboxamide?
N-cyclopropyl-N-(2-hydroxyethyl)-3,4-dihydro-2H-pyran-6-carboxamide has a molecular weight of 211.26 g/mol, XLogP of 0.66, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(2-hydroxyethyl)-3,4-dihydro-2H-pyran-6-carboxamide is sourced from PubChem (CID 99776373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).