N-[(2S)-2-(furan-2-yl)-2-hydroxypropyl]-4-phenylbenzamide

C20H19NO3 — CID 95983664

IUPACN-[(2S)-2-(furan-2-yl)-2-hydroxypropyl]-4-phenylbenzamide
SMILESC[C@](O)(CNC(=O)c1ccc(-c2ccccc2)cc1)c1ccco1
InChIInChI=1S/C20H19NO3/c1-20(23,18-8-5-13-24-18)14-21-19(22)17-11-9-16(10-12-17)15-6-3-2-4-7-15/h2-13,23H,14H2,1H3,(H,21,22)/t20-/m0/s1
InChIKeyURWPVFPKTDOXIN-FQEVSTJZSA-N
MW321.38 g/mol
LogP3.58
Rot. Bonds5

About N-[(2S)-2-(furan-2-yl)-2-hydroxypropyl]-4-phenylbenzamide

N-[(2S)-2-(furan-2-yl)-2-hydroxypropyl]-4-phenylbenzamide (PubChem CID 95983664) has the molecular formula C20H19NO3 and a molecular weight of 321.38 g/mol. Its IUPAC name is N-[(2S)-2-(furan-2-yl)-2-hydroxypropyl]-4-phenylbenzamide.

Molecular Properties

Compound NameN-[(2S)-2-(furan-2-yl)-2-hydroxypropyl]-4-phenylbenzamide
PubChem CID95983664
Molecular FormulaC20H19NO3
Molecular Weight321.38 g/mol
Exact Mass321.14
IUPAC NameN-[(2S)-2-(furan-2-yl)-2-hydroxypropyl]-4-phenylbenzamide
SMILESC[C@](O)(CNC(=O)c1ccc(-c2ccccc2)cc1)c1ccco1
InChIInChI=1S/C20H19NO3/c1-20(23,18-8-5-13-24-18)14-21-19(22)17-11-9-16(10-12-17)15-6-3-2-4-7-15/h2-13,23H,14H2,1H3,(H,21,22)/t20-/m0/s1
InChIKeyURWPVFPKTDOXIN-FQEVSTJZSA-N
XLogP3.58
TPSA62.47 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 53.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide
CID 111482452
N-[2-(furan-2-yl)-2-hydroxypropyl]-4-nitrobenzamide
CID 111482013
2-chloro-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide
CID 71782549
N-[2-(furan-2-yl)-2-hydroxypropyl]thiophene-3-carboxamide
CID 71782534
N-[2-(furan-2-yl)-2-hydroxypropyl]-5-phenyl-1H-pyrazole-4-carboxamide
CID 111482271
N-[2-(furan-2-yl)-2-hydroxypropyl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide
CID 111482538
2,6-dichloro-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide
CID 71975267
N-[2-(furan-2-yl)-2-hydroxypropyl]-4-pyridin-3-yloxybenzamide
CID 111481964
4-[[ethyl(propan-2-yl)amino]methyl]-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide
CID 111482555
N-[2-(furan-2-yl)-2-hydroxypropyl]naphthalene-1-carboxamide
CID 71782562
2-chloro-N-[2-(furan-2-yl)-2-hydroxypropyl]pyridine-4-carboxamide
CID 111482264
N-[2-(furan-2-yl)-2-hydroxypropyl]-N'-phenyloxamide
CID 71782588

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-2-(furan-2-yl)-2-hydroxypropyl]-4-phenylbenzamide?
The IUPAC name of N-[(2S)-2-(furan-2-yl)-2-hydroxypropyl]-4-phenylbenzamide (CID 95983664) is N-[(2S)-2-(furan-2-yl)-2-hydroxypropyl]-4-phenylbenzamide.
What is the SMILES notation for N-[(2S)-2-(furan-2-yl)-2-hydroxypropyl]-4-phenylbenzamide?
The canonical SMILES for N-[(2S)-2-(furan-2-yl)-2-hydroxypropyl]-4-phenylbenzamide is C[C@](O)(CNC(=O)c1ccc(-c2ccccc2)cc1)c1ccco1.
What is the InChIKey of N-[(2S)-2-(furan-2-yl)-2-hydroxypropyl]-4-phenylbenzamide?
The InChIKey is URWPVFPKTDOXIN-FQEVSTJZSA-N. The full InChI is InChI=1S/C20H19NO3/c1-20(23,18-8-5-13-24-18)14-21-19(22)17-11-9-16(10-12-17)15-6-3-2-4-7-15/h2-13,23H,14H2,1H3,(H,21,22)/t20-/m0/s1.
What are the key properties of N-[(2S)-2-(furan-2-yl)-2-hydroxypropyl]-4-phenylbenzamide?
N-[(2S)-2-(furan-2-yl)-2-hydroxypropyl]-4-phenylbenzamide has a molecular weight of 321.38 g/mol, XLogP of 3.58, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-2-(furan-2-yl)-2-hydroxypropyl]-4-phenylbenzamide is sourced from PubChem (CID 95983664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).