N-amino-N'-cyclopropyl-2-ethyl-5-methylpyrazole-3-carboximidamide

C10H17N5 — CID 66122637

IUPACN-amino-N'-cyclopropyl-2-ethyl-5-methylpyrazole-3-carboximidamide
SMILESCCn1nc(C)cc1/C(=N/C1CC1)NN
InChIInChI=1S/C10H17N5/c1-3-15-9(6-7(2)14-15)10(13-11)12-8-4-5-8/h6,8H,3-5,11H2,1-2H3,(H,12,13)
InChIKeyFIAVMTDVEOELLN-UHFFFAOYSA-N
MW207.28 g/mol
LogP0.58
Rot. Bonds3

About N-amino-N'-cyclopropyl-2-ethyl-5-methylpyrazole-3-carboximidamide

N-amino-N'-cyclopropyl-2-ethyl-5-methylpyrazole-3-carboximidamide (PubChem CID 66122637) has the molecular formula C10H17N5 and a molecular weight of 207.28 g/mol. Its IUPAC name is N-amino-N'-cyclopropyl-2-ethyl-5-methylpyrazole-3-carboximidamide.

Molecular Properties

Compound NameN-amino-N'-cyclopropyl-2-ethyl-5-methylpyrazole-3-carboximidamide
PubChem CID66122637
Molecular FormulaC10H17N5
Molecular Weight207.28 g/mol
Exact Mass207.15
IUPAC NameN-amino-N'-cyclopropyl-2-ethyl-5-methylpyrazole-3-carboximidamide
SMILESCCn1nc(C)cc1/C(=N/C1CC1)NN
InChIInChI=1S/C10H17N5/c1-3-15-9(6-7(2)14-15)10(13-11)12-8-4-5-8/h6,8H,3-5,11H2,1-2H3,(H,12,13)
InChIKeyFIAVMTDVEOELLN-UHFFFAOYSA-N
XLogP0.58
TPSA68.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-amino-N'-cyclopropyl-1,3-diethylpyrazole-5-carboximidamide
CID 66120241
ethyl (3S)-1-(2-ethyl-5-methylpyrazole-3-carbonyl)piperidine-3-carboxylate
CID 81338249
1-(2-ethyl-5-methylpyrazole-3-carbonyl)piperidine-3-sulfonamide
CID 64867620
ethyl 1-(2-ethyl-5-methylpyrazole-3-carbonyl)piperidine-2-carboxylate
CID 78991936
N-(2-aminocyclohexyl)-2-ethyl-5-methylpyrazole-3-carboxamide
CID 66119695
N-amino-1,3-diethyl-N'-propan-2-ylpyrazole-5-carboximidamide
CID 66120240
methyl 2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]cycloheptane-1-carboxylate
CID 71972240
1-(2-ethyl-5-methylpyrazole-3-carbonyl)-N'-hydroxypiperidine-4-carboximidamide
CID 77113272
N-[(2-aminocyclopentyl)methyl]-2-ethyl-5-methylpyrazole-3-carboxamide
CID 66120497
aziridin-1-yl-(2-ethyl-5-methylpyrazol-3-yl)methanone
CID 127002241
N-(8-azabicyclo[3.2.1]octan-3-yl)-2-ethyl-5-methylpyrazole-3-carboxamide
CID 66119890
(3-amino-4-methylpyrrolidin-1-yl)-(2-ethyl-5-methylpyrazol-3-yl)methanone
CID 103575707

Frequently Asked Questions

What is the IUPAC name of N-amino-N'-cyclopropyl-2-ethyl-5-methylpyrazole-3-carboximidamide?
The IUPAC name of N-amino-N'-cyclopropyl-2-ethyl-5-methylpyrazole-3-carboximidamide (CID 66122637) is N-amino-N'-cyclopropyl-2-ethyl-5-methylpyrazole-3-carboximidamide.
What is the SMILES notation for N-amino-N'-cyclopropyl-2-ethyl-5-methylpyrazole-3-carboximidamide?
The canonical SMILES for N-amino-N'-cyclopropyl-2-ethyl-5-methylpyrazole-3-carboximidamide is CCn1nc(C)cc1/C(=N/C1CC1)NN.
What is the InChIKey of N-amino-N'-cyclopropyl-2-ethyl-5-methylpyrazole-3-carboximidamide?
The InChIKey is FIAVMTDVEOELLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5/c1-3-15-9(6-7(2)14-15)10(13-11)12-8-4-5-8/h6,8H,3-5,11H2,1-2H3,(H,12,13).
What are the key properties of N-amino-N'-cyclopropyl-2-ethyl-5-methylpyrazole-3-carboximidamide?
N-amino-N'-cyclopropyl-2-ethyl-5-methylpyrazole-3-carboximidamide has a molecular weight of 207.28 g/mol, XLogP of 0.58, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-amino-N'-cyclopropyl-2-ethyl-5-methylpyrazole-3-carboximidamide is sourced from PubChem (CID 66122637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).