N'-(2-methylpropanoyl)adamantane-1-carbohydrazide

C15H24N2O2 — CID 2869304

IUPACN'-(2-methylpropanoyl)adamantane-1-carbohydrazide
SMILESCC(C)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C15H24N2O2/c1-9(2)13(18)16-17-14(19)15-6-10-3-11(7-15)5-12(4-10)8-15/h9-12H,3-8H2,1-2H3,(H,16,18)(H,17,19)
InChIKeyCRSKJIOHWZNSOM-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.01
Rot. Bonds2

About N'-(2-methylpropanoyl)adamantane-1-carbohydrazide

N'-(2-methylpropanoyl)adamantane-1-carbohydrazide (PubChem CID 2869304) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N'-(2-methylpropanoyl)adamantane-1-carbohydrazide.

Molecular Properties

Compound NameN'-(2-methylpropanoyl)adamantane-1-carbohydrazide
PubChem CID2869304
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN'-(2-methylpropanoyl)adamantane-1-carbohydrazide
SMILESCC(C)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C15H24N2O2/c1-9(2)13(18)16-17-14(19)15-6-10-3-11(7-15)5-12(4-10)8-15/h9-12H,3-8H2,1-2H3,(H,16,18)(H,17,19)
InChIKeyCRSKJIOHWZNSOM-UHFFFAOYSA-N
XLogP2.01
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.01
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

N-[(2R)-1-[2-(adamantane-1-carbonyl)hydrazinyl]-3-methyl-1-oxobutan-2-yl]cyclohexanecarboxamide
CID 26046629
N'-butanoyladamantane-1-carbohydrazide
CID 24538351
N-[(2R)-1-(methylamino)-1-oxopropan-2-yl]adamantane-1-carboxamide
CID 7432877
N-[(1R)-1-(1-adamantyl)ethyl]adamantane-1-carboxamide
CID 7065184
N-[(2R)-1-hydrazinyl-1-oxopropan-2-yl]adamantane-1-carboxamide
CID 7090487
N-(3-bromo-2-methylpropyl)adamantane-1-carboxamide
CID 113275308
N-[(2R)-2-hydroxypropyl]adamantane-1-carboxamide
CID 7106778
N-[(2S,3S)-1-[2-(adamantane-1-carbonyl)hydrazinyl]-3-methyl-1-oxopentan-2-yl]benzamide
CID 7613266
N-[1-(tert-butylamino)-1-oxopropan-2-yl]adamantane-1-carboxamide
CID 3344892
N-[(2S)-1-[2-(tert-butylcarbamothioyl)hydrazinyl]-3-methyl-1-oxobutan-2-yl]adamantane-1-carboxamide
CID 9425931
N-propan-2-ylbicyclo[1.1.1]pentane-1-carboxamide
CID 146427466
3-ethyl-7-methyl-N-(2-methylpropanoyl)bicyclo[3.3.1]nonane-1-carboxamide
CID 170265396

Frequently Asked Questions

What is the IUPAC name of N'-(2-methylpropanoyl)adamantane-1-carbohydrazide?
The IUPAC name of N'-(2-methylpropanoyl)adamantane-1-carbohydrazide (CID 2869304) is N'-(2-methylpropanoyl)adamantane-1-carbohydrazide.
What is the SMILES notation for N'-(2-methylpropanoyl)adamantane-1-carbohydrazide?
The canonical SMILES for N'-(2-methylpropanoyl)adamantane-1-carbohydrazide is CC(C)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2.
What is the InChIKey of N'-(2-methylpropanoyl)adamantane-1-carbohydrazide?
The InChIKey is CRSKJIOHWZNSOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-9(2)13(18)16-17-14(19)15-6-10-3-11(7-15)5-12(4-10)8-15/h9-12H,3-8H2,1-2H3,(H,16,18)(H,17,19).
What are the key properties of N'-(2-methylpropanoyl)adamantane-1-carbohydrazide?
N'-(2-methylpropanoyl)adamantane-1-carbohydrazide has a molecular weight of 264.37 g/mol, XLogP of 2.01, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-methylpropanoyl)adamantane-1-carbohydrazide is sourced from PubChem (CID 2869304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).