1-[[5-(hydrazinecarbonyl)-2-methylfuran-3-yl]methyl]-N-methylpiperidine-2-carboxamide

C14H22N4O3 — CID 63585489

IUPAC1-[[5-(hydrazinecarbonyl)-2-methylfuran-3-yl]methyl]-N-methylpiperidine-2-carboxamide
SMILESCNC(=O)C1CCCCN1Cc1cc(C(=O)NN)oc1C
InChIInChI=1S/C14H22N4O3/c1-9-10(7-12(21-9)14(20)17-15)8-18-6-4-3-5-11(18)13(19)16-2/h7,11H,3-6,8,15H2,1-2H3,(H,16,19)(H,17,20)
InChIKeyZFDFLIJWMPYEFM-UHFFFAOYSA-N
MW294.35 g/mol
LogP0.29
Rot. Bonds4

About 1-[[5-(hydrazinecarbonyl)-2-methylfuran-3-yl]methyl]-N-methylpiperidine-2-carboxamide

1-[[5-(hydrazinecarbonyl)-2-methylfuran-3-yl]methyl]-N-methylpiperidine-2-carboxamide (PubChem CID 63585489) has the molecular formula C14H22N4O3 and a molecular weight of 294.35 g/mol. Its IUPAC name is 1-[[5-(hydrazinecarbonyl)-2-methylfuran-3-yl]methyl]-N-methylpiperidine-2-carboxamide.

Molecular Properties

Compound Name1-[[5-(hydrazinecarbonyl)-2-methylfuran-3-yl]methyl]-N-methylpiperidine-2-carboxamide
PubChem CID63585489
Molecular FormulaC14H22N4O3
Molecular Weight294.35 g/mol
Exact Mass294.17
IUPAC Name1-[[5-(hydrazinecarbonyl)-2-methylfuran-3-yl]methyl]-N-methylpiperidine-2-carboxamide
SMILESCNC(=O)C1CCCCN1Cc1cc(C(=O)NN)oc1C
InChIInChI=1S/C14H22N4O3/c1-9-10(7-12(21-9)14(20)17-15)8-18-6-4-3-5-11(18)13(19)16-2/h7,11H,3-6,8,15H2,1-2H3,(H,16,19)(H,17,20)
InChIKeyZFDFLIJWMPYEFM-UHFFFAOYSA-N
XLogP0.29
TPSA100.60 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 50.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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

5-methyl-4-[[2-(methylcarbamoyl)pyrrolidin-1-yl]methyl]furan-2-carboxylic acid
CID 62274666
1-[[5-(hydrazinecarbonyl)-2-methylfuran-3-yl]methyl]pyrrolidine-2-carboxamide
CID 63569410
4-[(2-ethylpiperidin-1-yl)methyl]-5-methylfuran-2-carbohydrazide
CID 63572887
1-[(2-tert-butyl-5-carbamoylfuran-3-yl)methyl]-N-methylpiperidine-2-carboxamide
CID 91837890
4-(azocan-1-ylmethyl)-5-methylfuran-2-carbohydrazide
CID 63570994
1-[(5-amino-2-hydroxyphenyl)methyl]-N-methylpiperidine-2-carboxamide
CID 54985657
1-[(3-amino-2-methylphenyl)methyl]-N-methylpiperidine-2-carboxamide
CID 54985708
1-[(5-amino-2-chlorophenyl)methyl]-N-methylpiperidine-2-carboxamide
CID 54985656
1-[(2-hydroxyphenyl)methyl]-N-methylpiperidine-2-carboxamide
CID 82978861
1-[(5-bromo-2-hydroxy-3-methylphenyl)methyl]-N-methylpiperidine-2-carboxamide
CID 115903842
5-methyl-4-[(3-methyl-2-oxopiperidin-1-yl)methyl]furan-2-carbohydrazide
CID 104680451
5-methyl-4-[(2-methylpiperidin-1-yl)methyl]furan-2-carbonyl chloride
CID 82042224

Frequently Asked Questions

What is the IUPAC name of 1-[[5-(hydrazinecarbonyl)-2-methylfuran-3-yl]methyl]-N-methylpiperidine-2-carboxamide?
The IUPAC name of 1-[[5-(hydrazinecarbonyl)-2-methylfuran-3-yl]methyl]-N-methylpiperidine-2-carboxamide (CID 63585489) is 1-[[5-(hydrazinecarbonyl)-2-methylfuran-3-yl]methyl]-N-methylpiperidine-2-carboxamide.
What is the SMILES notation for 1-[[5-(hydrazinecarbonyl)-2-methylfuran-3-yl]methyl]-N-methylpiperidine-2-carboxamide?
The canonical SMILES for 1-[[5-(hydrazinecarbonyl)-2-methylfuran-3-yl]methyl]-N-methylpiperidine-2-carboxamide is CNC(=O)C1CCCCN1Cc1cc(C(=O)NN)oc1C.
What is the InChIKey of 1-[[5-(hydrazinecarbonyl)-2-methylfuran-3-yl]methyl]-N-methylpiperidine-2-carboxamide?
The InChIKey is ZFDFLIJWMPYEFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O3/c1-9-10(7-12(21-9)14(20)17-15)8-18-6-4-3-5-11(18)13(19)16-2/h7,11H,3-6,8,15H2,1-2H3,(H,16,19)(H,17,20).
What are the key properties of 1-[[5-(hydrazinecarbonyl)-2-methylfuran-3-yl]methyl]-N-methylpiperidine-2-carboxamide?
1-[[5-(hydrazinecarbonyl)-2-methylfuran-3-yl]methyl]-N-methylpiperidine-2-carboxamide has a molecular weight of 294.35 g/mol, XLogP of 0.29, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[5-(hydrazinecarbonyl)-2-methylfuran-3-yl]methyl]-N-methylpiperidine-2-carboxamide is sourced from PubChem (CID 63585489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).