N-(2-amino-2-methylpropyl)-2-pyrazol-1-ylpropanamide;dihydrochloride

C10H20Cl2N4O — CID 119626027

IUPACN-(2-amino-2-methylpropyl)-2-pyrazol-1-ylpropanamide;dihydrochloride
SMILESCC(C(=O)NCC(C)(C)N)n1cccn1.Cl.Cl
InChIInChI=1S/C10H18N4O.2ClH/c1-8(14-6-4-5-13-14)9(15)12-7-10(2,3)11;;/h4-6,8H,7,11H2,1-3H3,(H,12,15);2*1H
InChIKeyXLNZFNVGTLNDLD-UHFFFAOYSA-N
MW283.20 g/mol
LogP1.14
Rot. Bonds4

About N-(2-amino-2-methylpropyl)-2-pyrazol-1-ylpropanamide;dihydrochloride

N-(2-amino-2-methylpropyl)-2-pyrazol-1-ylpropanamide;dihydrochloride (PubChem CID 119626027) has the molecular formula C10H20Cl2N4O and a molecular weight of 283.20 g/mol. Its IUPAC name is N-(2-amino-2-methylpropyl)-2-pyrazol-1-ylpropanamide;dihydrochloride.

Molecular Properties

Compound NameN-(2-amino-2-methylpropyl)-2-pyrazol-1-ylpropanamide;dihydrochloride
PubChem CID119626027
Molecular FormulaC10H20Cl2N4O
Molecular Weight283.20 g/mol
Exact Mass282.10
IUPAC NameN-(2-amino-2-methylpropyl)-2-pyrazol-1-ylpropanamide;dihydrochloride
SMILESCC(C(=O)NCC(C)(C)N)n1cccn1.Cl.Cl
InChIInChI=1S/C10H18N4O.2ClH/c1-8(14-6-4-5-13-14)9(15)12-7-10(2,3)11;;/h4-6,8H,7,11H2,1-3H3,(H,12,15);2*1H
InChIKeyXLNZFNVGTLNDLD-UHFFFAOYSA-N
XLogP1.14
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.20
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-amino-2-methylpropan-2-yl)-2-pyrazol-1-ylpropanamide;dihydrochloride
CID 119521574
3-methyl-2-[(2-pyrazol-1-ylpropanoylamino)methyl]butanoic acid
CID 65220604
4,4-dimethyl-2-[(2-pyrazol-1-ylpropanoylamino)methyl]pentanoic acid
CID 107474489
N-(1-aminopropan-2-yl)-2-pyrazol-1-ylpropanamide
CID 63732994
2-methyl-3-(2-pyrazol-1-ylpropanoylamino)propanoic acid
CID 62676010
N-(2-tert-butylphenyl)-2-pyrazol-1-ylpropanamide
CID 47156271
(2S)-2-pyrazol-1-ylpropanamide
CID 42576360
2-pyrazol-1-ylpropanamide
CID 25248322
N-(4-hydroxybutan-2-yl)-2-pyrazol-1-ylpropanamide
CID 81047310
N-(3,3-diphenylpropyl)-2-pyrazol-1-ylpropanamide
CID 134060458
N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-2-pyrazol-1-ylpropanamide
CID 79252196
N-[(3-methylthiophen-2-yl)methyl]-2-pyrazol-1-ylpropanamide
CID 47163720

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-methylpropyl)-2-pyrazol-1-ylpropanamide;dihydrochloride?
The IUPAC name of N-(2-amino-2-methylpropyl)-2-pyrazol-1-ylpropanamide;dihydrochloride (CID 119626027) is N-(2-amino-2-methylpropyl)-2-pyrazol-1-ylpropanamide;dihydrochloride.
What is the SMILES notation for N-(2-amino-2-methylpropyl)-2-pyrazol-1-ylpropanamide;dihydrochloride?
The canonical SMILES for N-(2-amino-2-methylpropyl)-2-pyrazol-1-ylpropanamide;dihydrochloride is CC(C(=O)NCC(C)(C)N)n1cccn1.Cl.Cl.
What is the InChIKey of N-(2-amino-2-methylpropyl)-2-pyrazol-1-ylpropanamide;dihydrochloride?
The InChIKey is XLNZFNVGTLNDLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O.2ClH/c1-8(14-6-4-5-13-14)9(15)12-7-10(2,3)11;;/h4-6,8H,7,11H2,1-3H3,(H,12,15);2*1H.
What are the key properties of N-(2-amino-2-methylpropyl)-2-pyrazol-1-ylpropanamide;dihydrochloride?
N-(2-amino-2-methylpropyl)-2-pyrazol-1-ylpropanamide;dihydrochloride has a molecular weight of 283.20 g/mol, XLogP of 1.14, 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)-2-pyrazol-1-ylpropanamide;dihydrochloride is sourced from PubChem (CID 119626027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).