3-(4-methylpiperidin-1-yl)-2-phenylpropanehydrazide

C15H23N3O — CID 64566034

IUPAC3-(4-methylpiperidin-1-yl)-2-phenylpropanehydrazide
SMILESCC1CCN(CC(C(=O)NN)c2ccccc2)CC1
InChIInChI=1S/C15H23N3O/c1-12-7-9-18(10-8-12)11-14(15(19)17-16)13-5-3-2-4-6-13/h2-6,12,14H,7-11,16H2,1H3,(H,17,19)
InChIKeyVJBNLKLXQKLIOZ-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.49
Rot. Bonds4

About 3-(4-methylpiperidin-1-yl)-2-phenylpropanehydrazide

3-(4-methylpiperidin-1-yl)-2-phenylpropanehydrazide (PubChem CID 64566034) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 3-(4-methylpiperidin-1-yl)-2-phenylpropanehydrazide.

Molecular Properties

Compound Name3-(4-methylpiperidin-1-yl)-2-phenylpropanehydrazide
PubChem CID64566034
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name3-(4-methylpiperidin-1-yl)-2-phenylpropanehydrazide
SMILESCC1CCN(CC(C(=O)NN)c2ccccc2)CC1
InChIInChI=1S/C15H23N3O/c1-12-7-9-18(10-8-12)11-14(15(19)17-16)13-5-3-2-4-6-13/h2-6,12,14H,7-11,16H2,1H3,(H,17,19)
InChIKeyVJBNLKLXQKLIOZ-UHFFFAOYSA-N
XLogP1.49
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

3-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-2-phenylpropanehydrazide
CID 115562539
3-(3-methylpyrrolidin-1-yl)-2-phenylpropanoic acid
CID 63067114
methyl 3-[4-(hydroxymethyl)piperidin-1-yl]-2-phenylpropanoate
CID 64567065
2-amino-N-[2-(4-methylpiperidin-1-yl)ethyl]-2-phenylacetamide
CID 61241817
3-[cyclopropyl(ethyl)amino]-2-phenylpropanehydrazide
CID 64566245
N-[(1R)-2-hydroxy-1-phenylethyl]-2-(4-methylpiperidin-1-yl)acetamide
CID 100678867
3-(4-benzylpiperidin-1-yl)-2-methylpropanehydrazide
CID 63573249
2-chloro-N-[2-(4-methylpiperidin-1-yl)ethyl]-2-phenylacetamide
CID 61241452
2-methyl-3-(4-methylpiperidin-1-yl)-1-phenylpropan-1-one
CID 3599580
3-[3-(aminomethyl)pyrrolidin-1-yl]-2-phenylpropanoic acid
CID 64566086
1-(4-methylpiperidin-1-yl)-3-(1-phenylethylamino)propan-2-ol
CID 110904840
2-amino-N-[4-[(4-methylpiperidin-1-yl)methyl]phenyl]-2-phenylacetamide
CID 119844839

Frequently Asked Questions

What is the IUPAC name of 3-(4-methylpiperidin-1-yl)-2-phenylpropanehydrazide?
The IUPAC name of 3-(4-methylpiperidin-1-yl)-2-phenylpropanehydrazide (CID 64566034) is 3-(4-methylpiperidin-1-yl)-2-phenylpropanehydrazide.
What is the SMILES notation for 3-(4-methylpiperidin-1-yl)-2-phenylpropanehydrazide?
The canonical SMILES for 3-(4-methylpiperidin-1-yl)-2-phenylpropanehydrazide is CC1CCN(CC(C(=O)NN)c2ccccc2)CC1.
What is the InChIKey of 3-(4-methylpiperidin-1-yl)-2-phenylpropanehydrazide?
The InChIKey is VJBNLKLXQKLIOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-12-7-9-18(10-8-12)11-14(15(19)17-16)13-5-3-2-4-6-13/h2-6,12,14H,7-11,16H2,1H3,(H,17,19).
What are the key properties of 3-(4-methylpiperidin-1-yl)-2-phenylpropanehydrazide?
3-(4-methylpiperidin-1-yl)-2-phenylpropanehydrazide has a molecular weight of 261.37 g/mol, XLogP of 1.49, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methylpiperidin-1-yl)-2-phenylpropanehydrazide is sourced from PubChem (CID 64566034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).