N,N',5-trimethyl-1H-pyrazole-3-carbohydrazide

C7H12N4O — CID 13405307

IUPACN,N',5-trimethyl-1H-pyrazole-3-carbohydrazide
SMILESCNN(C)C(=O)c1cc(C)[nH]n1
InChIInChI=1S/C7H12N4O/c1-5-4-6(10-9-5)7(12)11(3)8-2/h4,8H,1-3H3,(H,9,10)
InChIKeyPNJXPXXSPPKCCI-UHFFFAOYSA-N
MW168.20 g/mol
LogP-0.08
Rot. Bonds2

About N,N',5-trimethyl-1H-pyrazole-3-carbohydrazide

N,N',5-trimethyl-1H-pyrazole-3-carbohydrazide (PubChem CID 13405307) has the molecular formula C7H12N4O and a molecular weight of 168.20 g/mol. Its IUPAC name is N,N',5-trimethyl-1H-pyrazole-3-carbohydrazide.

Molecular Properties

Compound NameN,N',5-trimethyl-1H-pyrazole-3-carbohydrazide
PubChem CID13405307
Molecular FormulaC7H12N4O
Molecular Weight168.20 g/mol
Exact Mass168.10
IUPAC NameN,N',5-trimethyl-1H-pyrazole-3-carbohydrazide
SMILESCNN(C)C(=O)c1cc(C)[nH]n1
InChIInChI=1S/C7H12N4O/c1-5-4-6(10-9-5)7(12)11(3)8-2/h4,8H,1-3H3,(H,9,10)
InChIKeyPNJXPXXSPPKCCI-UHFFFAOYSA-N
XLogP-0.08
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.20
LogP ≤ 5-0.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N,5-dimethyl-1H-pyrazole-3-carbohydrazide
CID 13405305
5-methyl-1H-pyrazole-3-carbonyl bromide
CID 167084964
N-(4-aminocyclohexyl)-N,5-dimethyl-1H-pyrazole-3-carboxamide
CID 79121302
N-ethyl-N-(2-hydroxy-2-methylpropyl)-5-methyl-1H-pyrazole-3-carboxamide
CID 111596679
4-methyl-2-[methyl-(5-methyl-1H-pyrazole-3-carbonyl)amino]pentanoic acid
CID 110835292
N-(2-fluoroethyl)-5-methyl-1H-pyrazole-3-carboxamide
CID 130978682
(Z)-4-(dimethylamino)-3-(5-methyl-1H-pyrazol-3-yl)but-3-en-2-one
CID 141243311
N-methoxy-5-methyl-1H-pyrazole-3-carboxamide
CID 126988470
N,5-dimethyl-N-(1-thiophen-2-ylethyl)-1H-pyrazole-3-carboxamide
CID 87021283
5-methyl-N-[(E)-3-methylsulfonylprop-2-enyl]-1H-pyrazole-3-carboxamide
CID 139018658
N-but-3-en-2-yl-5-methyl-1H-pyrazole-3-carboxamide
CID 126992210
N-(5-hydroxypentyl)-5-methyl-1H-pyrazole-3-carboxamide
CID 110484276

Frequently Asked Questions

What is the IUPAC name of N,N',5-trimethyl-1H-pyrazole-3-carbohydrazide?
The IUPAC name of N,N',5-trimethyl-1H-pyrazole-3-carbohydrazide (CID 13405307) is N,N',5-trimethyl-1H-pyrazole-3-carbohydrazide.
What is the SMILES notation for N,N',5-trimethyl-1H-pyrazole-3-carbohydrazide?
The canonical SMILES for N,N',5-trimethyl-1H-pyrazole-3-carbohydrazide is CNN(C)C(=O)c1cc(C)[nH]n1.
What is the InChIKey of N,N',5-trimethyl-1H-pyrazole-3-carbohydrazide?
The InChIKey is PNJXPXXSPPKCCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N4O/c1-5-4-6(10-9-5)7(12)11(3)8-2/h4,8H,1-3H3,(H,9,10).
What are the key properties of N,N',5-trimethyl-1H-pyrazole-3-carbohydrazide?
N,N',5-trimethyl-1H-pyrazole-3-carbohydrazide has a molecular weight of 168.20 g/mol, XLogP of -0.08, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N',5-trimethyl-1H-pyrazole-3-carbohydrazide is sourced from PubChem (CID 13405307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).