[1-(3,4-dimethylphenyl)-3-propoxypropan-2-yl]hydrazine

C14H24N2O — CID 105210031

IUPAC[1-(3,4-dimethylphenyl)-3-propoxypropan-2-yl]hydrazine
SMILESCCCOCC(Cc1ccc(C)c(C)c1)NN
InChIInChI=1S/C14H24N2O/c1-4-7-17-10-14(16-15)9-13-6-5-11(2)12(3)8-13/h5-6,8,14,16H,4,7,9-10,15H2,1-3H3
InChIKeyPGBVTSAHUXAGCL-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.10
Rot. Bonds7

About [1-(3,4-dimethylphenyl)-3-propoxypropan-2-yl]hydrazine

[1-(3,4-dimethylphenyl)-3-propoxypropan-2-yl]hydrazine (PubChem CID 105210031) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is [1-(3,4-dimethylphenyl)-3-propoxypropan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(3,4-dimethylphenyl)-3-propoxypropan-2-yl]hydrazine
PubChem CID105210031
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name[1-(3,4-dimethylphenyl)-3-propoxypropan-2-yl]hydrazine
SMILESCCCOCC(Cc1ccc(C)c(C)c1)NN
InChIInChI=1S/C14H24N2O/c1-4-7-17-10-14(16-15)9-13-6-5-11(2)12(3)8-13/h5-6,8,14,16H,4,7,9-10,15H2,1-3H3
InChIKeyPGBVTSAHUXAGCL-UHFFFAOYSA-N
XLogP2.10
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'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

[1-(3,4-dimethylphenyl)-3-methoxypropan-2-yl]hydrazine
CID 105207252
1,3-bis(3,4-dimethylphenyl)propan-2-ylhydrazine
CID 105215161
[1-(3,4-dimethylphenyl)-3-propan-2-yloxypropan-2-yl]hydrazine
CID 105215227
[1-(5-ethyl-2-pyridinyl)-3-propoxypropan-2-yl]hydrazine
CID 105209932
[1-(3,4-dimethylphenyl)-3-methylpentan-2-yl]hydrazine
CID 105215198
[1-(2,6-difluorophenyl)-3-propoxypropan-2-yl]hydrazine
CID 105210157
[1-cyclobutyl-3-(3,4-dimethylphenyl)propan-2-yl]hydrazine
CID 105215170
[1-(3,4-dimethylphenyl)-3-propylhexan-2-yl]hydrazine
CID 105289972
(1-naphthalen-1-yl-3-propoxypropan-2-yl)hydrazine
CID 105210084
1-(3,4-dimethylphenyl)hept-6-en-2-ylhydrazine
CID 105215088
1-(3,4-dimethylphenyl)-N-methyl-3-(2,2,2-trifluoroethoxy)propan-2-amine
CID 103214766
[1-(2-chloro-3-fluorophenyl)-3-(3,4-dimethylphenyl)propan-2-yl]hydrazine
CID 105215085

Frequently Asked Questions

What is the IUPAC name of [1-(3,4-dimethylphenyl)-3-propoxypropan-2-yl]hydrazine?
The IUPAC name of [1-(3,4-dimethylphenyl)-3-propoxypropan-2-yl]hydrazine (CID 105210031) is [1-(3,4-dimethylphenyl)-3-propoxypropan-2-yl]hydrazine.
What is the SMILES notation for [1-(3,4-dimethylphenyl)-3-propoxypropan-2-yl]hydrazine?
The canonical SMILES for [1-(3,4-dimethylphenyl)-3-propoxypropan-2-yl]hydrazine is CCCOCC(Cc1ccc(C)c(C)c1)NN.
What is the InChIKey of [1-(3,4-dimethylphenyl)-3-propoxypropan-2-yl]hydrazine?
The InChIKey is PGBVTSAHUXAGCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-4-7-17-10-14(16-15)9-13-6-5-11(2)12(3)8-13/h5-6,8,14,16H,4,7,9-10,15H2,1-3H3.
What are the key properties of [1-(3,4-dimethylphenyl)-3-propoxypropan-2-yl]hydrazine?
[1-(3,4-dimethylphenyl)-3-propoxypropan-2-yl]hydrazine has a molecular weight of 236.36 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 [1-(3,4-dimethylphenyl)-3-propoxypropan-2-yl]hydrazine is sourced from PubChem (CID 105210031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).