N-benzyl-N-[2-(furan-2-yl)-2-hydroxyethyl]-3,4-dihydro-2H-pyran-5-carboxamide

C19H21NO4 — CID 84586214

IUPACN-benzyl-N-[2-(furan-2-yl)-2-hydroxyethyl]-3,4-dihydro-2H-pyran-5-carboxamide
SMILESO=C(C1=COCCC1)N(Cc1ccccc1)CC(O)c1ccco1
InChIInChI=1S/C19H21NO4/c21-17(18-9-5-11-24-18)13-20(12-15-6-2-1-3-7-15)19(22)16-8-4-10-23-14-16/h1-3,5-7,9,11,14,17,21H,4,8,10,12-13H2
InChIKeyGTIGDYVFMPWOHP-UHFFFAOYSA-N
MW327.38 g/mol
LogP3.04
Rot. Bonds6

About N-benzyl-N-[2-(furan-2-yl)-2-hydroxyethyl]-3,4-dihydro-2H-pyran-5-carboxamide

N-benzyl-N-[2-(furan-2-yl)-2-hydroxyethyl]-3,4-dihydro-2H-pyran-5-carboxamide (PubChem CID 84586214) has the molecular formula C19H21NO4 and a molecular weight of 327.38 g/mol. Its IUPAC name is N-benzyl-N-[2-(furan-2-yl)-2-hydroxyethyl]-3,4-dihydro-2H-pyran-5-carboxamide.

Molecular Properties

Compound NameN-benzyl-N-[2-(furan-2-yl)-2-hydroxyethyl]-3,4-dihydro-2H-pyran-5-carboxamide
PubChem CID84586214
Molecular FormulaC19H21NO4
Molecular Weight327.38 g/mol
Exact Mass327.15
IUPAC NameN-benzyl-N-[2-(furan-2-yl)-2-hydroxyethyl]-3,4-dihydro-2H-pyran-5-carboxamide
SMILESO=C(C1=COCCC1)N(Cc1ccccc1)CC(O)c1ccco1
InChIInChI=1S/C19H21NO4/c21-17(18-9-5-11-24-18)13-20(12-15-6-2-1-3-7-15)19(22)16-8-4-10-23-14-16/h1-3,5-7,9,11,14,17,21H,4,8,10,12-13H2
InChIKeyGTIGDYVFMPWOHP-UHFFFAOYSA-N
XLogP3.04
TPSA62.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.38
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-benzyl-5-chloro-N-[2-(furan-2-yl)-2-hydroxyethyl]furan-2-carboxamide
CID 111969853
N-benzyl-N-[(2S)-2-(furan-2-yl)-2-hydroxyethyl]-1H-pyrrole-2-carboxamide
CID 97011235
N-benzyl-4-cyano-N-[2-(furan-2-yl)-2-hydroxyethyl]benzamide
CID 111969862
N-benzyl-N-[(2R)-2-(furan-2-yl)-2-hydroxyethyl]-6-methylpyridine-2-carboxamide
CID 97011240
N-benzyl-N-[2-(furan-2-yl)-2-hydroxyethyl]-6-oxo-1-phenyl-4,5-dihydropyridazine-3-carboxamide
CID 146129495
N-benzyl-2,4-difluoro-N-[2-(furan-2-yl)-2-hydroxyethyl]-5-methylbenzamide
CID 75425042
(Z)-N-benzyl-N-[2-(furan-2-yl)-2-hydroxyethyl]-2,3-dimethylpent-2-enamide
CID 110025714
N-benzyl-1-tert-butyl-N-[2-(furan-2-yl)-2-hydroxyethyl]-1,2,4-triazole-3-carboxamide
CID 139004625
N-benzyl-2-ethyl-N-[2-(furan-2-yl)-2-hydroxyethyl]-1H-imidazole-5-carboxamide
CID 111969855
2-(2-aminoethyl)-N-benzyl-N-[2-(furan-2-yl)-2-hydroxyethyl]-1,3-thiazole-4-carboxamide
CID 120638257
2-(2-aminoethyl)-N-benzyl-N-[2-(furan-2-yl)-2-hydroxyethyl]-1,3-thiazole-4-carboxamide;hydrochloride
CID 120638256
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-benzyl-N-[2-(furan-2-yl)-2-hydroxyethyl]acetamide
CID 119816817

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-[2-(furan-2-yl)-2-hydroxyethyl]-3,4-dihydro-2H-pyran-5-carboxamide?
The IUPAC name of N-benzyl-N-[2-(furan-2-yl)-2-hydroxyethyl]-3,4-dihydro-2H-pyran-5-carboxamide (CID 84586214) is N-benzyl-N-[2-(furan-2-yl)-2-hydroxyethyl]-3,4-dihydro-2H-pyran-5-carboxamide.
What is the SMILES notation for N-benzyl-N-[2-(furan-2-yl)-2-hydroxyethyl]-3,4-dihydro-2H-pyran-5-carboxamide?
The canonical SMILES for N-benzyl-N-[2-(furan-2-yl)-2-hydroxyethyl]-3,4-dihydro-2H-pyran-5-carboxamide is O=C(C1=COCCC1)N(Cc1ccccc1)CC(O)c1ccco1.
What is the InChIKey of N-benzyl-N-[2-(furan-2-yl)-2-hydroxyethyl]-3,4-dihydro-2H-pyran-5-carboxamide?
The InChIKey is GTIGDYVFMPWOHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO4/c21-17(18-9-5-11-24-18)13-20(12-15-6-2-1-3-7-15)19(22)16-8-4-10-23-14-16/h1-3,5-7,9,11,14,17,21H,4,8,10,12-13H2.
What are the key properties of N-benzyl-N-[2-(furan-2-yl)-2-hydroxyethyl]-3,4-dihydro-2H-pyran-5-carboxamide?
N-benzyl-N-[2-(furan-2-yl)-2-hydroxyethyl]-3,4-dihydro-2H-pyran-5-carboxamide has a molecular weight of 327.38 g/mol, XLogP of 3.04, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-[2-(furan-2-yl)-2-hydroxyethyl]-3,4-dihydro-2H-pyran-5-carboxamide is sourced from PubChem (CID 84586214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).