N-(1-amino-2,4-dimethylpentan-2-yl)-5-(furan-2-yl)-1H-pyrazole-3-carboxamide

C15H22N4O2 — CID 119599382

IUPACN-(1-amino-2,4-dimethylpentan-2-yl)-5-(furan-2-yl)-1H-pyrazole-3-carboxamide
SMILESCC(C)CC(C)(CN)NC(=O)c1cc(-c2ccco2)[nH]n1
InChIInChI=1S/C15H22N4O2/c1-10(2)8-15(3,9-16)17-14(20)12-7-11(18-19-12)13-5-4-6-21-13/h4-7,10H,8-9,16H2,1-3H3,(H,17,20)(H,18,19)
InChIKeyWHOXOEZWUJQDSX-UHFFFAOYSA-N
MW290.37 g/mol
LogP2.16
Rot. Bonds6

About N-(1-amino-2,4-dimethylpentan-2-yl)-5-(furan-2-yl)-1H-pyrazole-3-carboxamide

N-(1-amino-2,4-dimethylpentan-2-yl)-5-(furan-2-yl)-1H-pyrazole-3-carboxamide (PubChem CID 119599382) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is N-(1-amino-2,4-dimethylpentan-2-yl)-5-(furan-2-yl)-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound NameN-(1-amino-2,4-dimethylpentan-2-yl)-5-(furan-2-yl)-1H-pyrazole-3-carboxamide
PubChem CID119599382
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC NameN-(1-amino-2,4-dimethylpentan-2-yl)-5-(furan-2-yl)-1H-pyrazole-3-carboxamide
SMILESCC(C)CC(C)(CN)NC(=O)c1cc(-c2ccco2)[nH]n1
InChIInChI=1S/C15H22N4O2/c1-10(2)8-15(3,9-16)17-14(20)12-7-11(18-19-12)13-5-4-6-21-13/h4-7,10H,8-9,16H2,1-3H3,(H,17,20)(H,18,19)
InChIKeyWHOXOEZWUJQDSX-UHFFFAOYSA-N
XLogP2.16
TPSA96.94 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 52.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-tert-butyl-5-(furan-2-yl)-1H-pyrazole-3-carboxamide
CID 6626158
N-butan-2-yl-5-(furan-2-yl)-1H-pyrazole-3-carboxamide
CID 19513917
5-(furan-2-yl)-N-(2-hydroxy-2,5-dimethylhexyl)-1H-pyrazole-3-carboxamide
CID 111485372
N-(3-aminobutyl)-5-(furan-2-yl)-1H-pyrazole-3-carboxamide
CID 119498062
5-(furan-2-yl)-N-(3-hydroxy-2,2,4-trimethylpentyl)-1H-pyrazole-3-carboxamide
CID 109380983
N-(1-amino-2,4-dimethylpentan-2-yl)-5-cyclopropyl-1H-pyrazole-3-carboxamide;hydrochloride
CID 119597806
5-(furan-2-yl)-N-[(2R)-1-hydroxy-3-methylbutan-2-yl]-1H-pyrazole-3-carboxamide
CID 124848185
5-(furan-2-yl)-N-prop-2-ynyl-1H-pyrazole-3-carboxamide
CID 25353049
5-(furan-2-yl)-N-[(2R,3R)-1-hydroxy-3-methylpentan-2-yl]-1H-pyrazole-3-carboxamide
CID 124841426
5-(furan-2-yl)-N-[2-(methylamino)ethyl]-1H-pyrazole-3-carboxamide;hydrochloride
CID 119502872
5-(furan-2-yl)-N-(3-hydroxypropyl)-1H-pyrazole-3-carboxamide
CID 78854308
5-(furan-2-yl)-N-pentyl-1H-pyrazole-3-carboxamide
CID 25348232

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2,4-dimethylpentan-2-yl)-5-(furan-2-yl)-1H-pyrazole-3-carboxamide?
The IUPAC name of N-(1-amino-2,4-dimethylpentan-2-yl)-5-(furan-2-yl)-1H-pyrazole-3-carboxamide (CID 119599382) is N-(1-amino-2,4-dimethylpentan-2-yl)-5-(furan-2-yl)-1H-pyrazole-3-carboxamide.
What is the SMILES notation for N-(1-amino-2,4-dimethylpentan-2-yl)-5-(furan-2-yl)-1H-pyrazole-3-carboxamide?
The canonical SMILES for N-(1-amino-2,4-dimethylpentan-2-yl)-5-(furan-2-yl)-1H-pyrazole-3-carboxamide is CC(C)CC(C)(CN)NC(=O)c1cc(-c2ccco2)[nH]n1.
What is the InChIKey of N-(1-amino-2,4-dimethylpentan-2-yl)-5-(furan-2-yl)-1H-pyrazole-3-carboxamide?
The InChIKey is WHOXOEZWUJQDSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O2/c1-10(2)8-15(3,9-16)17-14(20)12-7-11(18-19-12)13-5-4-6-21-13/h4-7,10H,8-9,16H2,1-3H3,(H,17,20)(H,18,19).
What are the key properties of N-(1-amino-2,4-dimethylpentan-2-yl)-5-(furan-2-yl)-1H-pyrazole-3-carboxamide?
N-(1-amino-2,4-dimethylpentan-2-yl)-5-(furan-2-yl)-1H-pyrazole-3-carboxamide has a molecular weight of 290.37 g/mol, XLogP of 2.16, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2,4-dimethylpentan-2-yl)-5-(furan-2-yl)-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 119599382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).