N-(2-amino-4-methylpentyl)-1H-pyrazole-5-carboxamide

C10H18N4O — CID 107158805

IUPACN-(2-amino-4-methylpentyl)-1H-pyrazole-5-carboxamide
SMILESCC(C)CC(N)CNC(=O)c1ccn[nH]1
InChIInChI=1S/C10H18N4O/c1-7(2)5-8(11)6-12-10(15)9-3-4-13-14-9/h3-4,7-8H,5-6,11H2,1-2H3,(H,12,15)(H,13,14)
InChIKeyWGYYXJCPUPMQJF-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.51
Rot. Bonds5

About N-(2-amino-4-methylpentyl)-1H-pyrazole-5-carboxamide

N-(2-amino-4-methylpentyl)-1H-pyrazole-5-carboxamide (PubChem CID 107158805) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is N-(2-amino-4-methylpentyl)-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound NameN-(2-amino-4-methylpentyl)-1H-pyrazole-5-carboxamide
PubChem CID107158805
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC NameN-(2-amino-4-methylpentyl)-1H-pyrazole-5-carboxamide
SMILESCC(C)CC(N)CNC(=O)c1ccn[nH]1
InChIInChI=1S/C10H18N4O/c1-7(2)5-8(11)6-12-10(15)9-3-4-13-14-9/h3-4,7-8H,5-6,11H2,1-2H3,(H,12,15)(H,13,14)
InChIKeyWGYYXJCPUPMQJF-UHFFFAOYSA-N
XLogP0.51
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

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N-(4-bromo-2-methylbutyl)-1H-pyrazole-5-carboxamide
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CID 110018237
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CID 55128680
N-[2-cyclopropyl-2-(1H-pyrazole-5-carbonylamino)ethyl]-1H-pyrazole-5-carboxamide
CID 60615566
N-[2-(2-chloroethyl)pentyl]-1H-pyrazole-5-carboxamide
CID 106117591
N-(2-amino-4-methylpentyl)-2-methylpropanamide
CID 107158681
N-(2-sulfamoylethyl)-1H-pyrazole-5-carboxamide
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Frequently Asked Questions

What is the IUPAC name of N-(2-amino-4-methylpentyl)-1H-pyrazole-5-carboxamide?
The IUPAC name of N-(2-amino-4-methylpentyl)-1H-pyrazole-5-carboxamide (CID 107158805) is N-(2-amino-4-methylpentyl)-1H-pyrazole-5-carboxamide.
What is the SMILES notation for N-(2-amino-4-methylpentyl)-1H-pyrazole-5-carboxamide?
The canonical SMILES for N-(2-amino-4-methylpentyl)-1H-pyrazole-5-carboxamide is CC(C)CC(N)CNC(=O)c1ccn[nH]1.
What is the InChIKey of N-(2-amino-4-methylpentyl)-1H-pyrazole-5-carboxamide?
The InChIKey is WGYYXJCPUPMQJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-7(2)5-8(11)6-12-10(15)9-3-4-13-14-9/h3-4,7-8H,5-6,11H2,1-2H3,(H,12,15)(H,13,14).
What are the key properties of N-(2-amino-4-methylpentyl)-1H-pyrazole-5-carboxamide?
N-(2-amino-4-methylpentyl)-1H-pyrazole-5-carboxamide has a molecular weight of 210.28 g/mol, XLogP of 0.51, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-4-methylpentyl)-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 107158805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).