2-[1-(2-methoxyphenyl)propan-2-yl-methylamino]propanehydrazide

C14H23N3O2 — CID 65486572

IUPAC2-[1-(2-methoxyphenyl)propan-2-yl-methylamino]propanehydrazide
SMILESCOc1ccccc1CC(C)N(C)C(C)C(=O)NN
InChIInChI=1S/C14H23N3O2/c1-10(17(3)11(2)14(18)16-15)9-12-7-5-6-8-13(12)19-4/h5-8,10-11H,9,15H2,1-4H3,(H,16,18)
InChIKeyRPWNRYKSQHPNGT-UHFFFAOYSA-N
MW265.36 g/mol
LogP0.94
Rot. Bonds6

About 2-[1-(2-methoxyphenyl)propan-2-yl-methylamino]propanehydrazide

2-[1-(2-methoxyphenyl)propan-2-yl-methylamino]propanehydrazide (PubChem CID 65486572) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is 2-[1-(2-methoxyphenyl)propan-2-yl-methylamino]propanehydrazide.

Molecular Properties

Compound Name2-[1-(2-methoxyphenyl)propan-2-yl-methylamino]propanehydrazide
PubChem CID65486572
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC Name2-[1-(2-methoxyphenyl)propan-2-yl-methylamino]propanehydrazide
SMILESCOc1ccccc1CC(C)N(C)C(C)C(=O)NN
InChIInChI=1S/C14H23N3O2/c1-10(17(3)11(2)14(18)16-15)9-12-7-5-6-8-13(12)19-4/h5-8,10-11H,9,15H2,1-4H3,(H,16,18)
InChIKeyRPWNRYKSQHPNGT-UHFFFAOYSA-N
XLogP0.94
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 50.94
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'}

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Related Compounds

3-ethyl-1-[1-(2-methoxyphenyl)propan-2-yl]-1-methylurea
CID 71994436
methyl 2-[1-(2-methoxyphenyl)propan-2-yl-methylamino]-2-oxoacetate
CID 112617368
ethyl 2-[1-(2-methoxyphenyl)propan-2-yl-methylamino]butanoate
CID 65486472
3-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methyl-3-sulfanylidenepropanamide
CID 65486697
2-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylacetamide;hydrochloride
CID 119319100
1-[1-(2-methoxyphenyl)propan-2-yl]-1-methyl-3-propylurea
CID 115660984
4-amino-2-[1-(2-methoxyphenyl)propan-2-yl-methylamino]butanoic acid
CID 65487917
3-[(2-methoxyphenyl)methyl-methylamino]-2-methylbutanehydrazide
CID 79408377
2-chloro-N-[1-(2-methoxyphenyl)propan-2-yl-methylcarbamoyl]propanamide
CID 65488311
N-(cyanomethyl)-N'-[1-(2-methoxyphenyl)propan-2-yl]-N'-methyloxamide
CID 65486876
methyl 3-[1-(2-methoxyphenyl)propan-2-yl-methylamino]-2-(methylamino)propanoate
CID 65486136
3-amino-2-[1-(2-methoxyphenyl)propan-2-yl-methylamino]propan-1-ol
CID 104711070

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-methoxyphenyl)propan-2-yl-methylamino]propanehydrazide?
The IUPAC name of 2-[1-(2-methoxyphenyl)propan-2-yl-methylamino]propanehydrazide (CID 65486572) is 2-[1-(2-methoxyphenyl)propan-2-yl-methylamino]propanehydrazide.
What is the SMILES notation for 2-[1-(2-methoxyphenyl)propan-2-yl-methylamino]propanehydrazide?
The canonical SMILES for 2-[1-(2-methoxyphenyl)propan-2-yl-methylamino]propanehydrazide is COc1ccccc1CC(C)N(C)C(C)C(=O)NN.
What is the InChIKey of 2-[1-(2-methoxyphenyl)propan-2-yl-methylamino]propanehydrazide?
The InChIKey is RPWNRYKSQHPNGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-10(17(3)11(2)14(18)16-15)9-12-7-5-6-8-13(12)19-4/h5-8,10-11H,9,15H2,1-4H3,(H,16,18).
What are the key properties of 2-[1-(2-methoxyphenyl)propan-2-yl-methylamino]propanehydrazide?
2-[1-(2-methoxyphenyl)propan-2-yl-methylamino]propanehydrazide has a molecular weight of 265.36 g/mol, XLogP of 0.94, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-methoxyphenyl)propan-2-yl-methylamino]propanehydrazide is sourced from PubChem (CID 65486572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).