N'-[2-(1-hydroxycyclopentyl)acetyl]-2,5-dimethylfuran-3-carbohydrazide

C14H20N2O4 — CID 111536311

IUPACN'-[2-(1-hydroxycyclopentyl)acetyl]-2,5-dimethylfuran-3-carbohydrazide
SMILESCc1cc(C(=O)NNC(=O)CC2(O)CCCC2)c(C)o1
InChIInChI=1S/C14H20N2O4/c1-9-7-11(10(2)20-9)13(18)16-15-12(17)8-14(19)5-3-4-6-14/h7,19H,3-6,8H2,1-2H3,(H,15,17)(H,16,18)
InChIKeyOOADRZYFOKCUSH-UHFFFAOYSA-N
MW280.32 g/mol
LogP1.35
Rot. Bonds3

About N'-[2-(1-hydroxycyclopentyl)acetyl]-2,5-dimethylfuran-3-carbohydrazide

N'-[2-(1-hydroxycyclopentyl)acetyl]-2,5-dimethylfuran-3-carbohydrazide (PubChem CID 111536311) has the molecular formula C14H20N2O4 and a molecular weight of 280.32 g/mol. Its IUPAC name is N'-[2-(1-hydroxycyclopentyl)acetyl]-2,5-dimethylfuran-3-carbohydrazide.

Molecular Properties

Compound NameN'-[2-(1-hydroxycyclopentyl)acetyl]-2,5-dimethylfuran-3-carbohydrazide
PubChem CID111536311
Molecular FormulaC14H20N2O4
Molecular Weight280.32 g/mol
Exact Mass280.14
IUPAC NameN'-[2-(1-hydroxycyclopentyl)acetyl]-2,5-dimethylfuran-3-carbohydrazide
SMILESCc1cc(C(=O)NNC(=O)CC2(O)CCCC2)c(C)o1
InChIInChI=1S/C14H20N2O4/c1-9-7-11(10(2)20-9)13(18)16-15-12(17)8-14(19)5-3-4-6-14/h7,19H,3-6,8H2,1-2H3,(H,15,17)(H,16,18)
InChIKeyOOADRZYFOKCUSH-UHFFFAOYSA-N
XLogP1.35
TPSA91.57 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.32
LogP ≤ 51.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[(2,5-dimethylfuran-3-yl)methyl]-2-(1-hydroxycyclopentyl)acetamide
CID 111538738
N'-(2-methoxyacetyl)-2,5-dimethylfuran-3-carbohydrazide
CID 47102396
N-[1-[2-(1-hydroxycyclopentyl)acetyl]piperidin-4-yl]-2,5-dimethylfuran-3-carboxamide
CID 111537911
2,5-dimethyl-N'-[2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetyl]furan-3-carbohydrazide
CID 39708207
N'-[2-(1-hydroxycyclopentyl)acetyl]naphthalene-1-carbohydrazide
CID 111540138
N-[[1-(aminomethyl)cyclopentyl]methyl]-2,5-dimethylfuran-3-carboxamide
CID 113295147
2,5-dimethyl-N'-[2-(2-oxopiperidin-1-yl)acetyl]furan-3-carbohydrazide
CID 78866913
N'-[2-(4-iodophenoxy)acetyl]-2,5-dimethylfuran-3-carbohydrazide
CID 55332060
N'-benzoyl-2,5-dimethylfuran-3-carbohydrazide
CID 4808565
2,5-dimethyl-N'-(2-methylbenzoyl)furan-3-carbohydrazide
CID 7808967
N-(1-carbamothioylcyclopentyl)-2,5-dimethylfuran-3-carboxamide
CID 61119528
N'-(3,5-difluorobenzoyl)-2,5-dimethylfuran-3-carbohydrazide
CID 4808606

Frequently Asked Questions

What is the IUPAC name of N'-[2-(1-hydroxycyclopentyl)acetyl]-2,5-dimethylfuran-3-carbohydrazide?
The IUPAC name of N'-[2-(1-hydroxycyclopentyl)acetyl]-2,5-dimethylfuran-3-carbohydrazide (CID 111536311) is N'-[2-(1-hydroxycyclopentyl)acetyl]-2,5-dimethylfuran-3-carbohydrazide.
What is the SMILES notation for N'-[2-(1-hydroxycyclopentyl)acetyl]-2,5-dimethylfuran-3-carbohydrazide?
The canonical SMILES for N'-[2-(1-hydroxycyclopentyl)acetyl]-2,5-dimethylfuran-3-carbohydrazide is Cc1cc(C(=O)NNC(=O)CC2(O)CCCC2)c(C)o1.
What is the InChIKey of N'-[2-(1-hydroxycyclopentyl)acetyl]-2,5-dimethylfuran-3-carbohydrazide?
The InChIKey is OOADRZYFOKCUSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O4/c1-9-7-11(10(2)20-9)13(18)16-15-12(17)8-14(19)5-3-4-6-14/h7,19H,3-6,8H2,1-2H3,(H,15,17)(H,16,18).
What are the key properties of N'-[2-(1-hydroxycyclopentyl)acetyl]-2,5-dimethylfuran-3-carbohydrazide?
N'-[2-(1-hydroxycyclopentyl)acetyl]-2,5-dimethylfuran-3-carbohydrazide has a molecular weight of 280.32 g/mol, XLogP of 1.35, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(1-hydroxycyclopentyl)acetyl]-2,5-dimethylfuran-3-carbohydrazide is sourced from PubChem (CID 111536311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).