5-(4-benzylpiperidin-1-yl)pentanehydrazide

C17H27N3O — CID 18621443

IUPAC5-(4-benzylpiperidin-1-yl)pentanehydrazide
SMILESNNC(=O)CCCCN1CCC(Cc2ccccc2)CC1
InChIInChI=1S/C17H27N3O/c18-19-17(21)8-4-5-11-20-12-9-16(10-13-20)14-15-6-2-1-3-7-15/h1-3,6-7,16H,4-5,8-14,18H2,(H,19,21)
InChIKeyLOWYEGBPNLQUIS-UHFFFAOYSA-N
MW289.42 g/mol
LogP2.10
Rot. Bonds7

About 5-(4-benzylpiperidin-1-yl)pentanehydrazide

5-(4-benzylpiperidin-1-yl)pentanehydrazide (PubChem CID 18621443) has the molecular formula C17H27N3O and a molecular weight of 289.42 g/mol. Its IUPAC name is 5-(4-benzylpiperidin-1-yl)pentanehydrazide.

Molecular Properties

Compound Name5-(4-benzylpiperidin-1-yl)pentanehydrazide
PubChem CID18621443
Molecular FormulaC17H27N3O
Molecular Weight289.42 g/mol
Exact Mass289.22
IUPAC Name5-(4-benzylpiperidin-1-yl)pentanehydrazide
SMILESNNC(=O)CCCCN1CCC(Cc2ccccc2)CC1
InChIInChI=1S/C17H27N3O/c18-19-17(21)8-4-5-11-20-12-9-16(10-13-20)14-15-6-2-1-3-7-15/h1-3,6-7,16H,4-5,8-14,18H2,(H,19,21)
InChIKeyLOWYEGBPNLQUIS-UHFFFAOYSA-N
XLogP2.10
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.42
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-(4-benzylpiperidin-1-yl)propanehydrazide
CID 63572694
5-(4-benzylpiperidin-1-yl)-N'-hydroxypentanimidamide
CID 76905947
5-(4-ethylpiperidin-1-yl)pentanehydrazide
CID 63578403
methyl 3-(4-benzylpiperidin-1-yl)propanoate
CID 43091070
3-(4-benzylpiperidin-1-yl)-2-methylpropanehydrazide
CID 63573249
5-(4-hydroxypiperidin-1-yl)pentanehydrazide
CID 63571141
2-(4-benzylpiperidin-1-yl)ethylcarbamic acid
CID 166653471
5-(4-benzylpiperidin-1-yl)-1-carbazol-9-ylpentan-1-one;hydrochloride
CID 122483259
2-(4-benzylpiperidin-1-yl)acetamide
CID 6465422
N-(4-acetamidophenyl)-3-(4-benzylpiperidin-1-yl)propanamide
CID 109032583
3-(3-benzylpyrrolidin-1-yl)propanoic acid
CID 119138114
4-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]butanehydrazide
CID 63584815

Frequently Asked Questions

What is the IUPAC name of 5-(4-benzylpiperidin-1-yl)pentanehydrazide?
The IUPAC name of 5-(4-benzylpiperidin-1-yl)pentanehydrazide (CID 18621443) is 5-(4-benzylpiperidin-1-yl)pentanehydrazide.
What is the SMILES notation for 5-(4-benzylpiperidin-1-yl)pentanehydrazide?
The canonical SMILES for 5-(4-benzylpiperidin-1-yl)pentanehydrazide is NNC(=O)CCCCN1CCC(Cc2ccccc2)CC1.
What is the InChIKey of 5-(4-benzylpiperidin-1-yl)pentanehydrazide?
The InChIKey is LOWYEGBPNLQUIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O/c18-19-17(21)8-4-5-11-20-12-9-16(10-13-20)14-15-6-2-1-3-7-15/h1-3,6-7,16H,4-5,8-14,18H2,(H,19,21).
What are the key properties of 5-(4-benzylpiperidin-1-yl)pentanehydrazide?
5-(4-benzylpiperidin-1-yl)pentanehydrazide has a molecular weight of 289.42 g/mol, XLogP of 2.10, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-benzylpiperidin-1-yl)pentanehydrazide is sourced from PubChem (CID 18621443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).