5-methyl-N-(1-methylpyrrolidin-3-yl)-1H-pyrazole-4-carboxamide

C10H16N4O — CID 63997254

IUPAC5-methyl-N-(1-methylpyrrolidin-3-yl)-1H-pyrazole-4-carboxamide
SMILESCc1[nH]ncc1C(=O)NC1CCN(C)C1
InChIInChI=1S/C10H16N4O/c1-7-9(5-11-13-7)10(15)12-8-3-4-14(2)6-8/h5,8H,3-4,6H2,1-2H3,(H,11,13)(H,12,15)
InChIKeyBVNUBTROKJTVCJ-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.15
Rot. Bonds2

About 5-methyl-N-(1-methylpyrrolidin-3-yl)-1H-pyrazole-4-carboxamide

5-methyl-N-(1-methylpyrrolidin-3-yl)-1H-pyrazole-4-carboxamide (PubChem CID 63997254) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 5-methyl-N-(1-methylpyrrolidin-3-yl)-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-methyl-N-(1-methylpyrrolidin-3-yl)-1H-pyrazole-4-carboxamide
PubChem CID63997254
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name5-methyl-N-(1-methylpyrrolidin-3-yl)-1H-pyrazole-4-carboxamide
SMILESCc1[nH]ncc1C(=O)NC1CCN(C)C1
InChIInChI=1S/C10H16N4O/c1-7-9(5-11-13-7)10(15)12-8-3-4-14(2)6-8/h5,8H,3-4,6H2,1-2H3,(H,11,13)(H,12,15)
InChIKeyBVNUBTROKJTVCJ-UHFFFAOYSA-N
XLogP0.15
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(1-methylpyrrolidin-3-yl)-1H-pyrazole-4-carboxamide?
The IUPAC name of 5-methyl-N-(1-methylpyrrolidin-3-yl)-1H-pyrazole-4-carboxamide (CID 63997254) is 5-methyl-N-(1-methylpyrrolidin-3-yl)-1H-pyrazole-4-carboxamide.
What is the SMILES notation for 5-methyl-N-(1-methylpyrrolidin-3-yl)-1H-pyrazole-4-carboxamide?
The canonical SMILES for 5-methyl-N-(1-methylpyrrolidin-3-yl)-1H-pyrazole-4-carboxamide is Cc1[nH]ncc1C(=O)NC1CCN(C)C1.
What is the InChIKey of 5-methyl-N-(1-methylpyrrolidin-3-yl)-1H-pyrazole-4-carboxamide?
The InChIKey is BVNUBTROKJTVCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-7-9(5-11-13-7)10(15)12-8-3-4-14(2)6-8/h5,8H,3-4,6H2,1-2H3,(H,11,13)(H,12,15).
What are the key properties of 5-methyl-N-(1-methylpyrrolidin-3-yl)-1H-pyrazole-4-carboxamide?
5-methyl-N-(1-methylpyrrolidin-3-yl)-1H-pyrazole-4-carboxamide has a molecular weight of 208.26 g/mol, XLogP of 0.15, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(1-methylpyrrolidin-3-yl)-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 63997254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).