N-(2-amino-1-cyclopropylethyl)-5-ethyl-1H-pyrazole-3-carboxamide;hydrochloride

C11H19ClN4O — CID 119617013

IUPACN-(2-amino-1-cyclopropylethyl)-5-ethyl-1H-pyrazole-3-carboxamide;hydrochloride
SMILESCCc1cc(C(=O)NC(CN)C2CC2)n[nH]1.Cl
InChIInChI=1S/C11H18N4O.ClH/c1-2-8-5-9(15-14-8)11(16)13-10(6-12)7-3-4-7;/h5,7,10H,2-4,6,12H2,1H3,(H,13,16)(H,14,15);1H
InChIKeyWZQCXXLTVHSZBZ-UHFFFAOYSA-N
MW258.75 g/mol
LogP0.86
Rot. Bonds5

About N-(2-amino-1-cyclopropylethyl)-5-ethyl-1H-pyrazole-3-carboxamide;hydrochloride

N-(2-amino-1-cyclopropylethyl)-5-ethyl-1H-pyrazole-3-carboxamide;hydrochloride (PubChem CID 119617013) has the molecular formula C11H19ClN4O and a molecular weight of 258.75 g/mol. Its IUPAC name is N-(2-amino-1-cyclopropylethyl)-5-ethyl-1H-pyrazole-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(2-amino-1-cyclopropylethyl)-5-ethyl-1H-pyrazole-3-carboxamide;hydrochloride
PubChem CID119617013
Molecular FormulaC11H19ClN4O
Molecular Weight258.75 g/mol
Exact Mass258.12
IUPAC NameN-(2-amino-1-cyclopropylethyl)-5-ethyl-1H-pyrazole-3-carboxamide;hydrochloride
SMILESCCc1cc(C(=O)NC(CN)C2CC2)n[nH]1.Cl
InChIInChI=1S/C11H18N4O.ClH/c1-2-8-5-9(15-14-8)11(16)13-10(6-12)7-3-4-7;/h5,7,10H,2-4,6,12H2,1H3,(H,13,16)(H,14,15);1H
InChIKeyWZQCXXLTVHSZBZ-UHFFFAOYSA-N
XLogP0.86
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.75
LogP ≤ 50.86
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

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N-[(1R)-2-amino-1-cyclopropylethyl]-5-methyl-1H-indazole-3-carboxamide
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5-ethyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)-(oxan-4-yl)methyl]-1H-pyrazole-3-carboxamide
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Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclopropylethyl)-5-ethyl-1H-pyrazole-3-carboxamide;hydrochloride?
The IUPAC name of N-(2-amino-1-cyclopropylethyl)-5-ethyl-1H-pyrazole-3-carboxamide;hydrochloride (CID 119617013) is N-(2-amino-1-cyclopropylethyl)-5-ethyl-1H-pyrazole-3-carboxamide;hydrochloride.
What is the SMILES notation for N-(2-amino-1-cyclopropylethyl)-5-ethyl-1H-pyrazole-3-carboxamide;hydrochloride?
The canonical SMILES for N-(2-amino-1-cyclopropylethyl)-5-ethyl-1H-pyrazole-3-carboxamide;hydrochloride is CCc1cc(C(=O)NC(CN)C2CC2)n[nH]1.Cl.
What is the InChIKey of N-(2-amino-1-cyclopropylethyl)-5-ethyl-1H-pyrazole-3-carboxamide;hydrochloride?
The InChIKey is WZQCXXLTVHSZBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O.ClH/c1-2-8-5-9(15-14-8)11(16)13-10(6-12)7-3-4-7;/h5,7,10H,2-4,6,12H2,1H3,(H,13,16)(H,14,15);1H.
What are the key properties of N-(2-amino-1-cyclopropylethyl)-5-ethyl-1H-pyrazole-3-carboxamide;hydrochloride?
N-(2-amino-1-cyclopropylethyl)-5-ethyl-1H-pyrazole-3-carboxamide;hydrochloride has a molecular weight of 258.75 g/mol, XLogP of 0.86, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclopropylethyl)-5-ethyl-1H-pyrazole-3-carboxamide;hydrochloride is sourced from PubChem (CID 119617013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).