N-methyl-2-[(5-methylfuran-2-yl)methoxy]acetohydrazide

C9H14N2O3 — CID 116845409

IUPACN-methyl-2-[(5-methylfuran-2-yl)methoxy]acetohydrazide
SMILESCc1ccc(COCC(=O)N(C)N)o1
InChIInChI=1S/C9H14N2O3/c1-7-3-4-8(14-7)5-13-6-9(12)11(2)10/h3-4H,5-6,10H2,1-2H3
InChIKeyFSQGVOSJKKVMQK-UHFFFAOYSA-N
MW198.22 g/mol
LogP0.44
Rot. Bonds4

About N-methyl-2-[(5-methylfuran-2-yl)methoxy]acetohydrazide

N-methyl-2-[(5-methylfuran-2-yl)methoxy]acetohydrazide (PubChem CID 116845409) has the molecular formula C9H14N2O3 and a molecular weight of 198.22 g/mol. Its IUPAC name is N-methyl-2-[(5-methylfuran-2-yl)methoxy]acetohydrazide.

Molecular Properties

Compound NameN-methyl-2-[(5-methylfuran-2-yl)methoxy]acetohydrazide
PubChem CID116845409
Molecular FormulaC9H14N2O3
Molecular Weight198.22 g/mol
Exact Mass198.10
IUPAC NameN-methyl-2-[(5-methylfuran-2-yl)methoxy]acetohydrazide
SMILESCc1ccc(COCC(=O)N(C)N)o1
InChIInChI=1S/C9H14N2O3/c1-7-3-4-8(14-7)5-13-6-9(12)11(2)10/h3-4H,5-6,10H2,1-2H3
InChIKeyFSQGVOSJKKVMQK-UHFFFAOYSA-N
XLogP0.44
TPSA68.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.22
LogP ≤ 50.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

ethoxyethane;2-(ethoxymethyl)-5-methylfuran
CID 118958545
2-[(3,4-dimethylphenyl)methoxy]-N-methylacetohydrazide
CID 116845305
2-(2-aminoethoxy)-N-[2-(dimethylamino)ethyl]-N-[(5-methylfuran-2-yl)methyl]acetamide
CID 79474044
1-methoxy-3-[methyl-[(5-methylfuran-2-yl)methyl]amino]propan-2-one
CID 107507272
N-methyl-2-(naphthalen-2-ylmethoxy)acetohydrazide
CID 116845423
3-[2-[(5-methylfuran-2-yl)methoxy]ethoxy]propan-1-amine
CID 44720293
[2-[methyl-[(5-methylfuran-2-yl)methyl]amino]-2-oxoethyl] 2-(4-phenylmethoxyphenoxy)acetate
CID 8575019
chromium;formaldehyde;2-(methoxymethyl)-5-methylfuran
CID 173392423
(5-methylfuran-2-yl)methyl formate
CID 58489131
3-amino-1-methyl-1-[(5-methylfuran-2-yl)methyl]urea
CID 115192836
methyl-[(5-methylfuran-2-yl)methyl]carbamothioic S-acid
CID 115170193
azane;(5-methylfuran-2-yl)methanol
CID 175565780

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[(5-methylfuran-2-yl)methoxy]acetohydrazide?
The IUPAC name of N-methyl-2-[(5-methylfuran-2-yl)methoxy]acetohydrazide (CID 116845409) is N-methyl-2-[(5-methylfuran-2-yl)methoxy]acetohydrazide.
What is the SMILES notation for N-methyl-2-[(5-methylfuran-2-yl)methoxy]acetohydrazide?
The canonical SMILES for N-methyl-2-[(5-methylfuran-2-yl)methoxy]acetohydrazide is Cc1ccc(COCC(=O)N(C)N)o1.
What is the InChIKey of N-methyl-2-[(5-methylfuran-2-yl)methoxy]acetohydrazide?
The InChIKey is FSQGVOSJKKVMQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O3/c1-7-3-4-8(14-7)5-13-6-9(12)11(2)10/h3-4H,5-6,10H2,1-2H3.
What are the key properties of N-methyl-2-[(5-methylfuran-2-yl)methoxy]acetohydrazide?
N-methyl-2-[(5-methylfuran-2-yl)methoxy]acetohydrazide has a molecular weight of 198.22 g/mol, XLogP of 0.44, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[(5-methylfuran-2-yl)methoxy]acetohydrazide is sourced from PubChem (CID 116845409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).