2-[4-(2-methylpropyl)phenyl]propanehydrazide

C13H20N2O — CID 2736674

IUPAC2-[4-(2-methylpropyl)phenyl]propanehydrazide
SMILESCC(C)Cc1ccc(C(C)C(=O)NN)cc1
InChIInChI=1S/C13H20N2O/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(16)15-14/h4-7,9-10H,8,14H2,1-3H3,(H,15,16)
InChIKeyJVDPFQDYGHWBBX-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.98
Rot. Bonds4

About 2-[4-(2-methylpropyl)phenyl]propanehydrazide

2-[4-(2-methylpropyl)phenyl]propanehydrazide (PubChem CID 2736674) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 2-[4-(2-methylpropyl)phenyl]propanehydrazide.

Molecular Properties

Compound Name2-[4-(2-methylpropyl)phenyl]propanehydrazide
PubChem CID2736674
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name2-[4-(2-methylpropyl)phenyl]propanehydrazide
SMILESCC(C)Cc1ccc(C(C)C(=O)NN)cc1
InChIInChI=1S/C13H20N2O/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(16)15-14/h4-7,9-10H,8,14H2,1-3H3,(H,15,16)
InChIKeyJVDPFQDYGHWBBX-UHFFFAOYSA-N
XLogP1.98
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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

N,2-bis[4-(2-methylpropyl)phenyl]propanamide
CID 3436173
2-[4-(methoxymethyl)phenyl]propanehydrazide
CID 105351367
(2-hydrazinyl-2-oxoethyl) (2S)-2-[4-(2-methylpropyl)phenyl]propanoate
CID 70810306
N-butan-2-yl-2-[4-(2-methylpropyl)phenyl]propanamide
CID 11841279
2-[[(2S)-2-[4-(2-methylpropyl)phenyl]propanoyl]amino]acetic acid
CID 101407950
(2R)-N-[(2S)-1-hydroxypropan-2-yl]-2-[4-(2-methylpropyl)phenyl]propanamide
CID 11817897
(2R)-N-ethyl-2-[4-(2-methylpropyl)phenyl]propanamide;molecular hydrogen
CID 166540473
2-[4-(ethylsulfanylmethyl)phenyl]propanehydrazide
CID 105352360
3-[2-[4-(2-methylpropyl)phenyl]propanoylamino]propanoic acid
CID 85049753
(2R)-2-[4-(2-methylpropyl)phenyl]-N-(4-propan-2-ylphenyl)propanamide
CID 7313989
2-[4-(2-methylpropyl)phenyl]-N-[4-[4-[2-[4-(2-methylpropyl)phenyl]propanoylamino]phenyl]phenyl]propanamide
CID 54781151
2-[4-[[methyl(3-methylbutyl)amino]methyl]phenyl]propanehydrazide
CID 105351918

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-methylpropyl)phenyl]propanehydrazide?
The IUPAC name of 2-[4-(2-methylpropyl)phenyl]propanehydrazide (CID 2736674) is 2-[4-(2-methylpropyl)phenyl]propanehydrazide.
What is the SMILES notation for 2-[4-(2-methylpropyl)phenyl]propanehydrazide?
The canonical SMILES for 2-[4-(2-methylpropyl)phenyl]propanehydrazide is CC(C)Cc1ccc(C(C)C(=O)NN)cc1.
What is the InChIKey of 2-[4-(2-methylpropyl)phenyl]propanehydrazide?
The InChIKey is JVDPFQDYGHWBBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(16)15-14/h4-7,9-10H,8,14H2,1-3H3,(H,15,16).
What are the key properties of 2-[4-(2-methylpropyl)phenyl]propanehydrazide?
2-[4-(2-methylpropyl)phenyl]propanehydrazide has a molecular weight of 220.32 g/mol, XLogP of 1.98, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-methylpropyl)phenyl]propanehydrazide is sourced from PubChem (CID 2736674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).