2,3-dimethylcyclopropane-1-carbohydrazide

C6H12N2O — CID 141209160

IUPAC2,3-dimethylcyclopropane-1-carbohydrazide
SMILESCC1C(C)C1C(=O)NN
InChIInChI=1S/C6H12N2O/c1-3-4(2)5(3)6(9)8-7/h3-5H,7H2,1-2H3,(H,8,9)
InChIKeyUICTXRJKVVWRFT-UHFFFAOYSA-N
MW128.17 g/mol
LogP-0.12
Rot. Bonds1

About 2,3-dimethylcyclopropane-1-carbohydrazide

2,3-dimethylcyclopropane-1-carbohydrazide (PubChem CID 141209160) has the molecular formula C6H12N2O and a molecular weight of 128.17 g/mol. Its IUPAC name is 2,3-dimethylcyclopropane-1-carbohydrazide.

Molecular Properties

Compound Name2,3-dimethylcyclopropane-1-carbohydrazide
PubChem CID141209160
Molecular FormulaC6H12N2O
Molecular Weight128.17 g/mol
Exact Mass128.09
IUPAC Name2,3-dimethylcyclopropane-1-carbohydrazide
SMILESCC1C(C)C1C(=O)NN
InChIInChI=1S/C6H12N2O/c1-3-4(2)5(3)6(9)8-7/h3-5H,7H2,1-2H3,(H,8,9)
InChIKeyUICTXRJKVVWRFT-UHFFFAOYSA-N
XLogP-0.12
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.17
LogP ≤ 5-0.12
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

2,3-difluorocyclopropane-1-carbohydrazide
CID 142794817
diethyl 3,4-dimethylcyclobutane-1,2-dicarboxylate
CID 121013896
cis-(1R,2S)-2-methylcyclobutane-1-carbohydrazide
CID 139509215
(1R,6S)-bicyclo[4.1.0]hept-3-ene-7-carbohydrazide
CID 13349682
tert-butylsilane;hydrazinecarboxylic acid
CID 174755643
1-amino-3-(2,3-dimethylcyclobutyl)urea
CID 127009267
acetohydrazide
CID 169432654
cis-(1R,2S)-2-hydroxycyclopentane-1-carbohydrazide
CID 14687010
1-amino-3-(2-methylcyclopropyl)urea
CID 62408837
3,3-dimethylcyclobutane-1-carbohydrazide
CID 126971918
2-methylpyrrolidine-3-carbohydrazide
CID 79384311
(1R,2R,3S,4S)-3-aminobicyclo[2.2.1]hept-5-ene-2-carbohydrazide
CID 11205990

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethylcyclopropane-1-carbohydrazide?
The IUPAC name of 2,3-dimethylcyclopropane-1-carbohydrazide (CID 141209160) is 2,3-dimethylcyclopropane-1-carbohydrazide.
What is the SMILES notation for 2,3-dimethylcyclopropane-1-carbohydrazide?
The canonical SMILES for 2,3-dimethylcyclopropane-1-carbohydrazide is CC1C(C)C1C(=O)NN.
What is the InChIKey of 2,3-dimethylcyclopropane-1-carbohydrazide?
The InChIKey is UICTXRJKVVWRFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O/c1-3-4(2)5(3)6(9)8-7/h3-5H,7H2,1-2H3,(H,8,9).
What are the key properties of 2,3-dimethylcyclopropane-1-carbohydrazide?
2,3-dimethylcyclopropane-1-carbohydrazide has a molecular weight of 128.17 g/mol, XLogP of -0.12, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethylcyclopropane-1-carbohydrazide is sourced from PubChem (CID 141209160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).