N-(1-amino-4-methylpentan-2-yl)-6-pyrazol-1-ylpyridine-2-carboxamide;dihydrochloride

C15H23Cl2N5O — CID 119587084

IUPACN-(1-amino-4-methylpentan-2-yl)-6-pyrazol-1-ylpyridine-2-carboxamide;dihydrochloride
SMILESCC(C)CC(CN)NC(=O)c1cccc(-n2cccn2)n1.Cl.Cl
InChIInChI=1S/C15H21N5O.2ClH/c1-11(2)9-12(10-16)18-15(21)13-5-3-6-14(19-13)20-8-4-7-17-20;;/h3-8,11-12H,9-10,16H2,1-2H3,(H,18,21);2*1H
InChIKeyQKLYTZUGYPIIOB-UHFFFAOYSA-N
MW360.29 g/mol
LogP2.21
Rot. Bonds6

About N-(1-amino-4-methylpentan-2-yl)-6-pyrazol-1-ylpyridine-2-carboxamide;dihydrochloride

N-(1-amino-4-methylpentan-2-yl)-6-pyrazol-1-ylpyridine-2-carboxamide;dihydrochloride (PubChem CID 119587084) has the molecular formula C15H23Cl2N5O and a molecular weight of 360.29 g/mol. Its IUPAC name is N-(1-amino-4-methylpentan-2-yl)-6-pyrazol-1-ylpyridine-2-carboxamide;dihydrochloride.

Molecular Properties

Compound NameN-(1-amino-4-methylpentan-2-yl)-6-pyrazol-1-ylpyridine-2-carboxamide;dihydrochloride
PubChem CID119587084
Molecular FormulaC15H23Cl2N5O
Molecular Weight360.29 g/mol
Exact Mass359.13
IUPAC NameN-(1-amino-4-methylpentan-2-yl)-6-pyrazol-1-ylpyridine-2-carboxamide;dihydrochloride
SMILESCC(C)CC(CN)NC(=O)c1cccc(-n2cccn2)n1.Cl.Cl
InChIInChI=1S/C15H21N5O.2ClH/c1-11(2)9-12(10-16)18-15(21)13-5-3-6-14(19-13)20-8-4-7-17-20;;/h3-8,11-12H,9-10,16H2,1-2H3,(H,18,21);2*1H
InChIKeyQKLYTZUGYPIIOB-UHFFFAOYSA-N
XLogP2.21
TPSA85.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.29
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-amino-2-methylpropyl)-6-pyrazol-1-ylpyridine-2-carboxamide;dihydrochloride
CID 119628163
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CID 119588721
N-[(2R)-3-imidazol-1-yl-2-methylpropyl]-6-pyrazol-1-ylpyridine-2-carboxamide
CID 96570332
N-[(2S)-4-(furan-2-yl)-4-oxobutan-2-yl]-6-pyrazol-1-ylpyridine-2-carboxamide
CID 97086539
N-(1-amino-4-methylpentan-2-yl)quinoline-2-carboxamide
CID 63754723
3-cyclopropyl-2-[(6-pyrazol-1-ylpyridine-2-carbonyl)amino]propanoic acid
CID 120535926
N-(1-amino-4-methylpentan-2-yl)-2-phenyltriazole-4-carboxamide;hydrochloride
CID 119588205
N-(1-amino-4-methylpentan-2-yl)-1-methylpyrrole-2-carboxamide;hydrochloride
CID 119588537
N-(1-amino-4-methylpentan-2-yl)-2-methylpyrazole-3-carboxamide
CID 63754352
N-[(2S)-2-methoxy-2-phenylethyl]-6-pyrazol-1-ylpyridine-2-carboxamide
CID 99637282
N-(1-amino-4-methylpentan-2-yl)isoquinoline-1-carboxamide;dihydrochloride
CID 119586830
N-[2-(aminomethyl)cyclopentyl]-6-pyrazol-1-ylpyridine-2-carboxamide
CID 119602877

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-4-methylpentan-2-yl)-6-pyrazol-1-ylpyridine-2-carboxamide;dihydrochloride?
The IUPAC name of N-(1-amino-4-methylpentan-2-yl)-6-pyrazol-1-ylpyridine-2-carboxamide;dihydrochloride (CID 119587084) is N-(1-amino-4-methylpentan-2-yl)-6-pyrazol-1-ylpyridine-2-carboxamide;dihydrochloride.
What is the SMILES notation for N-(1-amino-4-methylpentan-2-yl)-6-pyrazol-1-ylpyridine-2-carboxamide;dihydrochloride?
The canonical SMILES for N-(1-amino-4-methylpentan-2-yl)-6-pyrazol-1-ylpyridine-2-carboxamide;dihydrochloride is CC(C)CC(CN)NC(=O)c1cccc(-n2cccn2)n1.Cl.Cl.
What is the InChIKey of N-(1-amino-4-methylpentan-2-yl)-6-pyrazol-1-ylpyridine-2-carboxamide;dihydrochloride?
The InChIKey is QKLYTZUGYPIIOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O.2ClH/c1-11(2)9-12(10-16)18-15(21)13-5-3-6-14(19-13)20-8-4-7-17-20;;/h3-8,11-12H,9-10,16H2,1-2H3,(H,18,21);2*1H.
What are the key properties of N-(1-amino-4-methylpentan-2-yl)-6-pyrazol-1-ylpyridine-2-carboxamide;dihydrochloride?
N-(1-amino-4-methylpentan-2-yl)-6-pyrazol-1-ylpyridine-2-carboxamide;dihydrochloride has a molecular weight of 360.29 g/mol, XLogP of 2.21, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-4-methylpentan-2-yl)-6-pyrazol-1-ylpyridine-2-carboxamide;dihydrochloride is sourced from PubChem (CID 119587084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).