3-[methyl(oxolan-2-ylmethyl)amino]-2-phenylpropanehydrazide

C15H23N3O2 — CID 64566065

IUPAC3-[methyl(oxolan-2-ylmethyl)amino]-2-phenylpropanehydrazide
SMILESCN(CC1CCCO1)CC(C(=O)NN)c1ccccc1
InChIInChI=1S/C15H23N3O2/c1-18(10-13-8-5-9-20-13)11-14(15(19)17-16)12-6-3-2-4-7-12/h2-4,6-7,13-14H,5,8-11,16H2,1H3,(H,17,19)
InChIKeyRNXJVRHMABXILG-UHFFFAOYSA-N
MW277.37 g/mol
LogP0.87
Rot. Bonds6

About 3-[methyl(oxolan-2-ylmethyl)amino]-2-phenylpropanehydrazide

3-[methyl(oxolan-2-ylmethyl)amino]-2-phenylpropanehydrazide (PubChem CID 64566065) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is 3-[methyl(oxolan-2-ylmethyl)amino]-2-phenylpropanehydrazide.

Molecular Properties

Compound Name3-[methyl(oxolan-2-ylmethyl)amino]-2-phenylpropanehydrazide
PubChem CID64566065
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC Name3-[methyl(oxolan-2-ylmethyl)amino]-2-phenylpropanehydrazide
SMILESCN(CC1CCCO1)CC(C(=O)NN)c1ccccc1
InChIInChI=1S/C15H23N3O2/c1-18(10-13-8-5-9-20-13)11-14(15(19)17-16)12-6-3-2-4-7-12/h2-4,6-7,13-14H,5,8-11,16H2,1H3,(H,17,19)
InChIKeyRNXJVRHMABXILG-UHFFFAOYSA-N
XLogP0.87
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 50.87
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 3-[methyl(oxolan-2-ylmethyl)amino]-2-phenylpropanehydrazide 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-methyl-3-[methyl(oxolan-2-ylmethyl)amino]-1-phenylpropan-1-one
CID 62613157
2-[4-[[methyl(oxolan-2-ylmethyl)amino]methyl]phenyl]propanehydrazide
CID 105351851
N-cyclopropyl-2-[(3-hydrazinyl-3-oxo-2-phenylpropyl)-methylamino]acetamide
CID 64566681
2-amino-N-methyl-N-(oxolan-2-ylmethyl)-2-phenylacetamide
CID 61436409
3-amino-N-methyl-N-(oxan-2-ylmethyl)-2-phenylpropanamide
CID 62876627
methyl 3-[cyclobutylmethyl(methyl)amino]-2-phenylpropanoate
CID 64567717
3-amino-N-[2-(oxolan-2-yl)ethyl]-2-phenylpropanamide
CID 62878363
methyl 3-[cyclopropylmethyl(methyl)amino]-2-phenylpropanoate
CID 64566456
3-[methyl(oxolan-2-ylmethyl)amino]-3-phenylpropanoic acid
CID 63073130
3-[cyclopropyl(ethyl)amino]-2-phenylpropanehydrazide
CID 64566245
3-[methyl(oxan-3-ylmethyl)amino]-2-phenylpropanoic acid
CID 63707876
2-[2-[methyl(oxolan-2-ylmethyl)amino]ethyl]benzoic acid
CID 104548757

Frequently Asked Questions

What is the IUPAC name of 3-[methyl(oxolan-2-ylmethyl)amino]-2-phenylpropanehydrazide?
The IUPAC name of 3-[methyl(oxolan-2-ylmethyl)amino]-2-phenylpropanehydrazide (CID 64566065) is 3-[methyl(oxolan-2-ylmethyl)amino]-2-phenylpropanehydrazide.
What is the SMILES notation for 3-[methyl(oxolan-2-ylmethyl)amino]-2-phenylpropanehydrazide?
The canonical SMILES for 3-[methyl(oxolan-2-ylmethyl)amino]-2-phenylpropanehydrazide is CN(CC1CCCO1)CC(C(=O)NN)c1ccccc1.
What is the InChIKey of 3-[methyl(oxolan-2-ylmethyl)amino]-2-phenylpropanehydrazide?
The InChIKey is RNXJVRHMABXILG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-18(10-13-8-5-9-20-13)11-14(15(19)17-16)12-6-3-2-4-7-12/h2-4,6-7,13-14H,5,8-11,16H2,1H3,(H,17,19).
What are the key properties of 3-[methyl(oxolan-2-ylmethyl)amino]-2-phenylpropanehydrazide?
3-[methyl(oxolan-2-ylmethyl)amino]-2-phenylpropanehydrazide has a molecular weight of 277.37 g/mol, XLogP of 0.87, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[methyl(oxolan-2-ylmethyl)amino]-2-phenylpropanehydrazide is sourced from PubChem (CID 64566065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).