5-methyl-4-[(4-methylpiperidin-1-yl)methyl]furan-2-carbohydrazide

C13H21N3O2 — CID 63569181

IUPAC5-methyl-4-[(4-methylpiperidin-1-yl)methyl]furan-2-carbohydrazide
SMILESCc1oc(C(=O)NN)cc1CN1CCC(C)CC1
InChIInChI=1S/C13H21N3O2/c1-9-3-5-16(6-4-9)8-11-7-12(13(17)15-14)18-10(11)2/h7,9H,3-6,8,14H2,1-2H3,(H,15,17)
InChIKeyFZTVKJZNVWYSAI-UHFFFAOYSA-N
MW251.33 g/mol
LogP1.42
Rot. Bonds3

About 5-methyl-4-[(4-methylpiperidin-1-yl)methyl]furan-2-carbohydrazide

5-methyl-4-[(4-methylpiperidin-1-yl)methyl]furan-2-carbohydrazide (PubChem CID 63569181) has the molecular formula C13H21N3O2 and a molecular weight of 251.33 g/mol. Its IUPAC name is 5-methyl-4-[(4-methylpiperidin-1-yl)methyl]furan-2-carbohydrazide.

Molecular Properties

Compound Name5-methyl-4-[(4-methylpiperidin-1-yl)methyl]furan-2-carbohydrazide
PubChem CID63569181
Molecular FormulaC13H21N3O2
Molecular Weight251.33 g/mol
Exact Mass251.16
IUPAC Name5-methyl-4-[(4-methylpiperidin-1-yl)methyl]furan-2-carbohydrazide
SMILESCc1oc(C(=O)NN)cc1CN1CCC(C)CC1
InChIInChI=1S/C13H21N3O2/c1-9-3-5-16(6-4-9)8-11-7-12(13(17)15-14)18-10(11)2/h7,9H,3-6,8,14H2,1-2H3,(H,15,17)
InChIKeyFZTVKJZNVWYSAI-UHFFFAOYSA-N
XLogP1.42
TPSA71.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 51.42
H-Bond Donors ≤ 52
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'}

Analyze 5-methyl-4-[(4-methylpiperidin-1-yl)methyl]furan-2-carbohydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[1-[[5-(hydrazinecarbonyl)-2-methylfuran-3-yl]methyl]piperidin-4-yl]acetamide
CID 63579534
4-(azocan-1-ylmethyl)-5-methylfuran-2-carbohydrazide
CID 63570994
5-methyl-4-(piperazin-1-ylmethyl)furan-2-carbohydrazide
CID 63583235
5-methyl-4-[(3-methyl-2-oxopiperidin-1-yl)methyl]furan-2-carbohydrazide
CID 104680451
5-methyl-4-[(2,2,6-trimethylmorpholin-4-yl)methyl]furan-2-carbohydrazide
CID 63583647
1-[[5-(hydrazinecarbonyl)-2-methylfuran-3-yl]methyl]pyrrolidine-2-carboxamide
CID 63569410
4-[[4-(acetamidomethyl)piperidin-1-yl]methyl]-5-methylfuran-2-carboxylic acid
CID 102736546
4-[(2-ethylpiperidin-1-yl)methyl]-5-methylfuran-2-carbohydrazide
CID 63572887
2-methyl-5-[(4-methylazepan-1-yl)methyl]furan-3-carbohydrazide
CID 63625273
1-[[5-(hydrazinecarbonyl)-2-methylfuran-3-yl]methyl]-N-methylpiperidine-2-carboxamide
CID 63585489
4-[(3,5-dioxomorpholin-4-yl)methyl]-5-methylfuran-2-carbohydrazide
CID 63577829
4-(hydroxymethyl)-5-methylfuran-2-carbohydrazide
CID 63576410

Frequently Asked Questions

What is the IUPAC name of 5-methyl-4-[(4-methylpiperidin-1-yl)methyl]furan-2-carbohydrazide?
The IUPAC name of 5-methyl-4-[(4-methylpiperidin-1-yl)methyl]furan-2-carbohydrazide (CID 63569181) is 5-methyl-4-[(4-methylpiperidin-1-yl)methyl]furan-2-carbohydrazide.
What is the SMILES notation for 5-methyl-4-[(4-methylpiperidin-1-yl)methyl]furan-2-carbohydrazide?
The canonical SMILES for 5-methyl-4-[(4-methylpiperidin-1-yl)methyl]furan-2-carbohydrazide is Cc1oc(C(=O)NN)cc1CN1CCC(C)CC1.
What is the InChIKey of 5-methyl-4-[(4-methylpiperidin-1-yl)methyl]furan-2-carbohydrazide?
The InChIKey is FZTVKJZNVWYSAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O2/c1-9-3-5-16(6-4-9)8-11-7-12(13(17)15-14)18-10(11)2/h7,9H,3-6,8,14H2,1-2H3,(H,15,17).
What are the key properties of 5-methyl-4-[(4-methylpiperidin-1-yl)methyl]furan-2-carbohydrazide?
5-methyl-4-[(4-methylpiperidin-1-yl)methyl]furan-2-carbohydrazide has a molecular weight of 251.33 g/mol, XLogP of 1.42, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-4-[(4-methylpiperidin-1-yl)methyl]furan-2-carbohydrazide is sourced from PubChem (CID 63569181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).