4-amino-N-cyclohexyl-N-methyl-1-propylpyrazole-3-carboxamide

C14H24N4O — CID 132586474

IUPAC4-amino-N-cyclohexyl-N-methyl-1-propylpyrazole-3-carboxamide
SMILESCCCn1cc(N)c(C(=O)N(C)C2CCCCC2)n1
InChIInChI=1S/C14H24N4O/c1-3-9-18-10-12(15)13(16-18)14(19)17(2)11-7-5-4-6-8-11/h10-11H,3-9,15H2,1-2H3
InChIKeyGOIGJBJFXHYVSH-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.28
Rot. Bonds4

About 4-amino-N-cyclohexyl-N-methyl-1-propylpyrazole-3-carboxamide

4-amino-N-cyclohexyl-N-methyl-1-propylpyrazole-3-carboxamide (PubChem CID 132586474) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 4-amino-N-cyclohexyl-N-methyl-1-propylpyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-cyclohexyl-N-methyl-1-propylpyrazole-3-carboxamide
PubChem CID132586474
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name4-amino-N-cyclohexyl-N-methyl-1-propylpyrazole-3-carboxamide
SMILESCCCn1cc(N)c(C(=O)N(C)C2CCCCC2)n1
InChIInChI=1S/C14H24N4O/c1-3-9-18-10-12(15)13(16-18)14(19)17(2)11-7-5-4-6-8-11/h10-11H,3-9,15H2,1-2H3
InChIKeyGOIGJBJFXHYVSH-UHFFFAOYSA-N
XLogP2.28
TPSA64.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-cyclohexyl-N-methyl-1-propylpyrazole-3-carboxamide?
The IUPAC name of 4-amino-N-cyclohexyl-N-methyl-1-propylpyrazole-3-carboxamide (CID 132586474) is 4-amino-N-cyclohexyl-N-methyl-1-propylpyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-N-cyclohexyl-N-methyl-1-propylpyrazole-3-carboxamide?
The canonical SMILES for 4-amino-N-cyclohexyl-N-methyl-1-propylpyrazole-3-carboxamide is CCCn1cc(N)c(C(=O)N(C)C2CCCCC2)n1.
What is the InChIKey of 4-amino-N-cyclohexyl-N-methyl-1-propylpyrazole-3-carboxamide?
The InChIKey is GOIGJBJFXHYVSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-3-9-18-10-12(15)13(16-18)14(19)17(2)11-7-5-4-6-8-11/h10-11H,3-9,15H2,1-2H3.
What are the key properties of 4-amino-N-cyclohexyl-N-methyl-1-propylpyrazole-3-carboxamide?
4-amino-N-cyclohexyl-N-methyl-1-propylpyrazole-3-carboxamide has a molecular weight of 264.37 g/mol, XLogP of 2.28, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-cyclohexyl-N-methyl-1-propylpyrazole-3-carboxamide is sourced from PubChem (CID 132586474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).