N'-tert-butyl-2-methylpentanehydrazide

C10H22N2O — CID 172682852

IUPACN'-tert-butyl-2-methylpentanehydrazide
SMILESCCCC(C)C(=O)NNC(C)(C)C
InChIInChI=1S/C10H22N2O/c1-6-7-8(2)9(13)11-12-10(3,4)5/h8,12H,6-7H2,1-5H3,(H,11,13)
InChIKeyAQGUZOCYWJRMHR-UHFFFAOYSA-N
MW186.30 g/mol
LogP1.84
Rot. Bonds4

About N'-tert-butyl-2-methylpentanehydrazide

N'-tert-butyl-2-methylpentanehydrazide (PubChem CID 172682852) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is N'-tert-butyl-2-methylpentanehydrazide.

Molecular Properties

Compound NameN'-tert-butyl-2-methylpentanehydrazide
PubChem CID172682852
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC NameN'-tert-butyl-2-methylpentanehydrazide
SMILESCCCC(C)C(=O)NNC(C)(C)C
InChIInChI=1S/C10H22N2O/c1-6-7-8(2)9(13)11-12-10(3,4)5/h8,12H,6-7H2,1-5H3,(H,11,13)
InChIKeyAQGUZOCYWJRMHR-UHFFFAOYSA-N
XLogP1.84
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(2-methylpentanoylamino)thiourea
CID 65217200
2-methyl-N-propan-2-ylpentanamide
CID 4628268
2-methylpentanehydrazide
CID 43183484
2,2,3-trimethyl-3-(2-methylpentanoylamino)butanoic acid
CID 65261594
2-methyl-2-(2-methylpentanoylamino)pentanoic acid
CID 43619107
N-(1-amino-3-methylpentan-3-yl)-2-methylpentanamide
CID 106164528
2-methyl-N-[2-(methylamino)ethyl]pentanamide
CID 62659666
(2S)-N-ethoxy-2-methylpentanamide
CID 90228672
N-(4-hydroxybutan-2-yl)-2-methylpentanamide
CID 81042782
(6S)-4,6-dimethylnonan-5-one
CID 177467625
N'-tert-butyl-2-methyl-N'-methylsulfonylpentanehydrazide
CID 158958763
N'-tert-butylpropanehydrazide
CID 88905686

Frequently Asked Questions

What is the IUPAC name of N'-tert-butyl-2-methylpentanehydrazide?
The IUPAC name of N'-tert-butyl-2-methylpentanehydrazide (CID 172682852) is N'-tert-butyl-2-methylpentanehydrazide.
What is the SMILES notation for N'-tert-butyl-2-methylpentanehydrazide?
The canonical SMILES for N'-tert-butyl-2-methylpentanehydrazide is CCCC(C)C(=O)NNC(C)(C)C.
What is the InChIKey of N'-tert-butyl-2-methylpentanehydrazide?
The InChIKey is AQGUZOCYWJRMHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-6-7-8(2)9(13)11-12-10(3,4)5/h8,12H,6-7H2,1-5H3,(H,11,13).
What are the key properties of N'-tert-butyl-2-methylpentanehydrazide?
N'-tert-butyl-2-methylpentanehydrazide has a molecular weight of 186.30 g/mol, XLogP of 1.84, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-tert-butyl-2-methylpentanehydrazide is sourced from PubChem (CID 172682852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).