N-(2-amino-2-methylpropyl)-1-ethylpyrazole-4-carboxamide

C10H18N4O — CID 119627511

IUPACN-(2-amino-2-methylpropyl)-1-ethylpyrazole-4-carboxamide
SMILESCCn1cc(C(=O)NCC(C)(C)N)cn1
InChIInChI=1S/C10H18N4O/c1-4-14-6-8(5-13-14)9(15)12-7-10(2,3)11/h5-6H,4,7,11H2,1-3H3,(H,12,15)
InChIKeyHXBAYEQCUQTNGI-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.37
Rot. Bonds4

About N-(2-amino-2-methylpropyl)-1-ethylpyrazole-4-carboxamide

N-(2-amino-2-methylpropyl)-1-ethylpyrazole-4-carboxamide (PubChem CID 119627511) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is N-(2-amino-2-methylpropyl)-1-ethylpyrazole-4-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-methylpropyl)-1-ethylpyrazole-4-carboxamide
PubChem CID119627511
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC NameN-(2-amino-2-methylpropyl)-1-ethylpyrazole-4-carboxamide
SMILESCCn1cc(C(=O)NCC(C)(C)N)cn1
InChIInChI=1S/C10H18N4O/c1-4-14-6-8(5-13-14)9(15)12-7-10(2,3)11/h5-6H,4,7,11H2,1-3H3,(H,12,15)
InChIKeyHXBAYEQCUQTNGI-UHFFFAOYSA-N
XLogP0.37
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 111484338
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CID 116590216
1-ethyl-N-[2-hydroxy-2-(5-methylfuran-2-yl)propyl]pyrazole-4-carboxamide
CID 111481472
1-ethyl-N-propan-2-ylpyrazole-4-carboxamide
CID 19281043
1-ethyl-N-(1-hydroxy-3-methylpentan-3-yl)pyrazole-4-carboxamide
CID 75498992
1-(1-ethylpyrazol-4-yl)ethanone
CID 4912928
1-(1-ethylpyrazol-4-yl)-3,3-dimethylbutan-1-one
CID 63891496
1-ethyl-N-(3-hydroxy-4-methylpentyl)pyrazole-4-carboxamide
CID 111460800
N-(2-amino-2-ethylbutyl)-1-benzylpyrazole-4-carboxamide
CID 119641319
tert-butyl 1-ethylpyrazole-4-carboxylate
CID 175447582
N-(2-amino-2-methylpropyl)-1-(2,4-dichlorophenyl)pyrazole-4-carboxamide
CID 119630624
N-(3-carbamoyl-2-methylpentan-3-yl)-1-ethylpyrazole-4-carboxamide
CID 75519336

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-methylpropyl)-1-ethylpyrazole-4-carboxamide?
The IUPAC name of N-(2-amino-2-methylpropyl)-1-ethylpyrazole-4-carboxamide (CID 119627511) is N-(2-amino-2-methylpropyl)-1-ethylpyrazole-4-carboxamide.
What is the SMILES notation for N-(2-amino-2-methylpropyl)-1-ethylpyrazole-4-carboxamide?
The canonical SMILES for N-(2-amino-2-methylpropyl)-1-ethylpyrazole-4-carboxamide is CCn1cc(C(=O)NCC(C)(C)N)cn1.
What is the InChIKey of N-(2-amino-2-methylpropyl)-1-ethylpyrazole-4-carboxamide?
The InChIKey is HXBAYEQCUQTNGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-4-14-6-8(5-13-14)9(15)12-7-10(2,3)11/h5-6H,4,7,11H2,1-3H3,(H,12,15).
What are the key properties of N-(2-amino-2-methylpropyl)-1-ethylpyrazole-4-carboxamide?
N-(2-amino-2-methylpropyl)-1-ethylpyrazole-4-carboxamide has a molecular weight of 210.28 g/mol, XLogP of 0.37, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-methylpropyl)-1-ethylpyrazole-4-carboxamide is sourced from PubChem (CID 119627511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).