N',N'-dimethyl-5-(2,4,6-trimethylphenyl)pentanehydrazide

C16H26N2O — CID 116847795

IUPACN',N'-dimethyl-5-(2,4,6-trimethylphenyl)pentanehydrazide
SMILESCc1cc(C)c(CCCCC(=O)NN(C)C)c(C)c1
InChIInChI=1S/C16H26N2O/c1-12-10-13(2)15(14(3)11-12)8-6-7-9-16(19)17-18(4)5/h10-11H,6-9H2,1-5H3,(H,17,19)
InChIKeySVZMOIBRQLNRQO-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.92
Rot. Bonds6

About N',N'-dimethyl-5-(2,4,6-trimethylphenyl)pentanehydrazide

N',N'-dimethyl-5-(2,4,6-trimethylphenyl)pentanehydrazide (PubChem CID 116847795) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is N',N'-dimethyl-5-(2,4,6-trimethylphenyl)pentanehydrazide.

Molecular Properties

Compound NameN',N'-dimethyl-5-(2,4,6-trimethylphenyl)pentanehydrazide
PubChem CID116847795
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC NameN',N'-dimethyl-5-(2,4,6-trimethylphenyl)pentanehydrazide
SMILESCc1cc(C)c(CCCCC(=O)NN(C)C)c(C)c1
InChIInChI=1S/C16H26N2O/c1-12-10-13(2)15(14(3)11-12)8-6-7-9-16(19)17-18(4)5/h10-11H,6-9H2,1-5H3,(H,17,19)
InChIKeySVZMOIBRQLNRQO-UHFFFAOYSA-N
XLogP2.92
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N',N'-dimethyl-2-(2,4,6-trimethylphenyl)acetohydrazide
CID 116847434
N',N'-dimethyl-3-(2,3,5,6-tetramethylphenyl)propanehydrazide
CID 116847580
4-(2,5-dimethylphenyl)-N',N'-dimethylbutanehydrazide
CID 116847676
5-(4-ethylphenyl)-N',N'-dimethylpentanehydrazide
CID 116847774
N',N'-dimethyl-5-(5-methylfuran-2-yl)pentanehydrazide
CID 116847821
6-[4-(2,4,6-trimethylphenyl)butanoylamino]hexanoic acid
CID 94966889
4-(4-fluoro-3-methylphenyl)-N',N'-dimethylbutanehydrazide
CID 116847682
3-(2-methoxy-3,4,6-trimethylphenyl)-N',N'-dimethylpropanehydrazide
CID 116847658
N',N'-dimethyl-5-(4-methylsulfanylphenyl)pentanehydrazide
CID 116847805
3-hydroxy-2-[4-(2,4,6-trimethylphenyl)butanoylamino]propanoic acid
CID 82224458
N',N'-dimethyl-3-(6-methylnaphthalen-2-yl)propanehydrazide
CID 116847656
3-sulfanyl-N-[2-(2,4,6-trimethylphenyl)ethyl]propanamide
CID 115168005

Frequently Asked Questions

What is the IUPAC name of N',N'-dimethyl-5-(2,4,6-trimethylphenyl)pentanehydrazide?
The IUPAC name of N',N'-dimethyl-5-(2,4,6-trimethylphenyl)pentanehydrazide (CID 116847795) is N',N'-dimethyl-5-(2,4,6-trimethylphenyl)pentanehydrazide.
What is the SMILES notation for N',N'-dimethyl-5-(2,4,6-trimethylphenyl)pentanehydrazide?
The canonical SMILES for N',N'-dimethyl-5-(2,4,6-trimethylphenyl)pentanehydrazide is Cc1cc(C)c(CCCCC(=O)NN(C)C)c(C)c1.
What is the InChIKey of N',N'-dimethyl-5-(2,4,6-trimethylphenyl)pentanehydrazide?
The InChIKey is SVZMOIBRQLNRQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-12-10-13(2)15(14(3)11-12)8-6-7-9-16(19)17-18(4)5/h10-11H,6-9H2,1-5H3,(H,17,19).
What are the key properties of N',N'-dimethyl-5-(2,4,6-trimethylphenyl)pentanehydrazide?
N',N'-dimethyl-5-(2,4,6-trimethylphenyl)pentanehydrazide has a molecular weight of 262.40 g/mol, XLogP of 2.92, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-dimethyl-5-(2,4,6-trimethylphenyl)pentanehydrazide is sourced from PubChem (CID 116847795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).