4-amino-N-(1-cyclohexylpropyl)-1-methylpyrazole-3-carboxamide

C14H24N4O — CID 65354049

IUPAC4-amino-N-(1-cyclohexylpropyl)-1-methylpyrazole-3-carboxamide
SMILESCCC(NC(=O)c1nn(C)cc1N)C1CCCCC1
InChIInChI=1S/C14H24N4O/c1-3-12(10-7-5-4-6-8-10)16-14(19)13-11(15)9-18(2)17-13/h9-10,12H,3-8,15H2,1-2H3,(H,16,19)
InChIKeyKTEVMYXRHAZVOH-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.09
Rot. Bonds4

About 4-amino-N-(1-cyclohexylpropyl)-1-methylpyrazole-3-carboxamide

4-amino-N-(1-cyclohexylpropyl)-1-methylpyrazole-3-carboxamide (PubChem CID 65354049) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 4-amino-N-(1-cyclohexylpropyl)-1-methylpyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-(1-cyclohexylpropyl)-1-methylpyrazole-3-carboxamide
PubChem CID65354049
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name4-amino-N-(1-cyclohexylpropyl)-1-methylpyrazole-3-carboxamide
SMILESCCC(NC(=O)c1nn(C)cc1N)C1CCCCC1
InChIInChI=1S/C14H24N4O/c1-3-12(10-7-5-4-6-8-10)16-14(19)13-11(15)9-18(2)17-13/h9-10,12H,3-8,15H2,1-2H3,(H,16,19)
InChIKeyKTEVMYXRHAZVOH-UHFFFAOYSA-N
XLogP2.09
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(1-cyclohexylpropyl)-1-methylpyrazole-3-carboxamide?
The IUPAC name of 4-amino-N-(1-cyclohexylpropyl)-1-methylpyrazole-3-carboxamide (CID 65354049) is 4-amino-N-(1-cyclohexylpropyl)-1-methylpyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-N-(1-cyclohexylpropyl)-1-methylpyrazole-3-carboxamide?
The canonical SMILES for 4-amino-N-(1-cyclohexylpropyl)-1-methylpyrazole-3-carboxamide is CCC(NC(=O)c1nn(C)cc1N)C1CCCCC1.
What is the InChIKey of 4-amino-N-(1-cyclohexylpropyl)-1-methylpyrazole-3-carboxamide?
The InChIKey is KTEVMYXRHAZVOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-3-12(10-7-5-4-6-8-10)16-14(19)13-11(15)9-18(2)17-13/h9-10,12H,3-8,15H2,1-2H3,(H,16,19).
What are the key properties of 4-amino-N-(1-cyclohexylpropyl)-1-methylpyrazole-3-carboxamide?
4-amino-N-(1-cyclohexylpropyl)-1-methylpyrazole-3-carboxamide has a molecular weight of 264.37 g/mol, XLogP of 2.09, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(1-cyclohexylpropyl)-1-methylpyrazole-3-carboxamide is sourced from PubChem (CID 65354049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).