N-[(3R)-3-(furan-3-yl)-3-hydroxypropyl]-N'-phenyloxamide

C15H16N2O4 — CID 97106351

IUPACN-[(3R)-3-(furan-3-yl)-3-hydroxypropyl]-N'-phenyloxamide
SMILESO=C(NCC[C@@H](O)c1ccoc1)C(=O)Nc1ccccc1
InChIInChI=1S/C15H16N2O4/c18-13(11-7-9-21-10-11)6-8-16-14(19)15(20)17-12-4-2-1-3-5-12/h1-5,7,9-10,13,18H,6,8H2,(H,16,19)(H,17,20)/t13-/m1/s1
InChIKeyJHRKIOSFSPYUQS-CYBMUJFWSA-N
MW288.30 g/mol
LogP1.46
Rot. Bonds5

About N-[(3R)-3-(furan-3-yl)-3-hydroxypropyl]-N'-phenyloxamide

N-[(3R)-3-(furan-3-yl)-3-hydroxypropyl]-N'-phenyloxamide (PubChem CID 97106351) has the molecular formula C15H16N2O4 and a molecular weight of 288.30 g/mol. Its IUPAC name is N-[(3R)-3-(furan-3-yl)-3-hydroxypropyl]-N'-phenyloxamide.

Molecular Properties

Compound NameN-[(3R)-3-(furan-3-yl)-3-hydroxypropyl]-N'-phenyloxamide
PubChem CID97106351
Molecular FormulaC15H16N2O4
Molecular Weight288.30 g/mol
Exact Mass288.11
IUPAC NameN-[(3R)-3-(furan-3-yl)-3-hydroxypropyl]-N'-phenyloxamide
SMILESO=C(NCC[C@@H](O)c1ccoc1)C(=O)Nc1ccccc1
InChIInChI=1S/C15H16N2O4/c18-13(11-7-9-21-10-11)6-8-16-14(19)15(20)17-12-4-2-1-3-5-12/h1-5,7,9-10,13,18H,6,8H2,(H,16,19)(H,17,20)/t13-/m1/s1
InChIKeyJHRKIOSFSPYUQS-CYBMUJFWSA-N
XLogP1.46
TPSA91.57 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.30
LogP ≤ 51.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

N-[3-(furan-3-yl)-3-hydroxypropyl]-N'-(4-propan-2-ylphenyl)oxamide
CID 121132940
N-[(3S)-3-(furan-3-yl)-3-hydroxypropyl]-N'-[(1S)-1-phenylethyl]oxamide
CID 97106356
N-[3-(furan-3-yl)-3-hydroxypropyl]-N'-(2-methylpropyl)oxamide
CID 121132914
1-benzhydryl-3-[(3S)-3-(furan-3-yl)-3-hydroxypropyl]urea
CID 97106424
N-[(3R)-3-(furan-3-yl)-3-hydroxypropyl]-N'-(thiophen-2-ylmethyl)oxamide
CID 97106355
1-[(3R)-3-(furan-3-yl)-3-hydroxypropyl]-3-(2-methylphenyl)urea
CID 97106401
N-[(3S)-3-(furan-3-yl)-3-hydroxypropyl]-N'-(2-oxo-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-7-yl)oxamide
CID 97106397
1-[3-(furan-3-yl)-3-hydroxypropyl]-3-(4-methoxyphenyl)urea
CID 121132989
1-[(3R)-3-(furan-3-yl)-3-hydroxypropyl]-3-[4-(trifluoromethyl)phenyl]urea
CID 97106421
N-[3-(furan-3-yl)-3-hydroxypropyl]-N'-[4-methyl-3-(2-oxopyrrolidin-1-yl)phenyl]oxamide
CID 121132968
N-(3-hydroxy-4-methylpentyl)-N'-phenyloxamide
CID 111461297
N-[(2S)-2-(furan-3-yl)-2-hydroxyethyl]-N'-[4-(trifluoromethyl)phenyl]oxamide
CID 95986774

Frequently Asked Questions

What is the IUPAC name of N-[(3R)-3-(furan-3-yl)-3-hydroxypropyl]-N'-phenyloxamide?
The IUPAC name of N-[(3R)-3-(furan-3-yl)-3-hydroxypropyl]-N'-phenyloxamide (CID 97106351) is N-[(3R)-3-(furan-3-yl)-3-hydroxypropyl]-N'-phenyloxamide.
What is the SMILES notation for N-[(3R)-3-(furan-3-yl)-3-hydroxypropyl]-N'-phenyloxamide?
The canonical SMILES for N-[(3R)-3-(furan-3-yl)-3-hydroxypropyl]-N'-phenyloxamide is O=C(NCC[C@@H](O)c1ccoc1)C(=O)Nc1ccccc1.
What is the InChIKey of N-[(3R)-3-(furan-3-yl)-3-hydroxypropyl]-N'-phenyloxamide?
The InChIKey is JHRKIOSFSPYUQS-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H16N2O4/c18-13(11-7-9-21-10-11)6-8-16-14(19)15(20)17-12-4-2-1-3-5-12/h1-5,7,9-10,13,18H,6,8H2,(H,16,19)(H,17,20)/t13-/m1/s1.
What are the key properties of N-[(3R)-3-(furan-3-yl)-3-hydroxypropyl]-N'-phenyloxamide?
N-[(3R)-3-(furan-3-yl)-3-hydroxypropyl]-N'-phenyloxamide has a molecular weight of 288.30 g/mol, XLogP of 1.46, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3R)-3-(furan-3-yl)-3-hydroxypropyl]-N'-phenyloxamide is sourced from PubChem (CID 97106351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).