4-amino-1-ethyl-N-(2-phenylcyclopropyl)pyrazole-5-carboxamide

C15H18N4O — CID 65358906

IUPAC4-amino-1-ethyl-N-(2-phenylcyclopropyl)pyrazole-5-carboxamide
SMILESCCn1ncc(N)c1C(=O)NC1CC1c1ccccc1
InChIInChI=1S/C15H18N4O/c1-2-19-14(12(16)9-17-19)15(20)18-13-8-11(13)10-6-4-3-5-7-10/h3-7,9,11,13H,2,8,16H2,1H3,(H,18,20)
InChIKeyGMVKMPZRUKTJIM-UHFFFAOYSA-N
MW270.34 g/mol
LogP1.77
Rot. Bonds4

About 4-amino-1-ethyl-N-(2-phenylcyclopropyl)pyrazole-5-carboxamide

4-amino-1-ethyl-N-(2-phenylcyclopropyl)pyrazole-5-carboxamide (PubChem CID 65358906) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is 4-amino-1-ethyl-N-(2-phenylcyclopropyl)pyrazole-5-carboxamide.

Molecular Properties

Compound Name4-amino-1-ethyl-N-(2-phenylcyclopropyl)pyrazole-5-carboxamide
PubChem CID65358906
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC Name4-amino-1-ethyl-N-(2-phenylcyclopropyl)pyrazole-5-carboxamide
SMILESCCn1ncc(N)c1C(=O)NC1CC1c1ccccc1
InChIInChI=1S/C15H18N4O/c1-2-19-14(12(16)9-17-19)15(20)18-13-8-11(13)10-6-4-3-5-7-10/h3-7,9,11,13H,2,8,16H2,1H3,(H,18,20)
InChIKeyGMVKMPZRUKTJIM-UHFFFAOYSA-N
XLogP1.77
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-amino-1-ethyl-N-(2-phenylcyclopropyl)pyrazole-5-carboxamide?
The IUPAC name of 4-amino-1-ethyl-N-(2-phenylcyclopropyl)pyrazole-5-carboxamide (CID 65358906) is 4-amino-1-ethyl-N-(2-phenylcyclopropyl)pyrazole-5-carboxamide.
What is the SMILES notation for 4-amino-1-ethyl-N-(2-phenylcyclopropyl)pyrazole-5-carboxamide?
The canonical SMILES for 4-amino-1-ethyl-N-(2-phenylcyclopropyl)pyrazole-5-carboxamide is CCn1ncc(N)c1C(=O)NC1CC1c1ccccc1.
What is the InChIKey of 4-amino-1-ethyl-N-(2-phenylcyclopropyl)pyrazole-5-carboxamide?
The InChIKey is GMVKMPZRUKTJIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c1-2-19-14(12(16)9-17-19)15(20)18-13-8-11(13)10-6-4-3-5-7-10/h3-7,9,11,13H,2,8,16H2,1H3,(H,18,20).
What are the key properties of 4-amino-1-ethyl-N-(2-phenylcyclopropyl)pyrazole-5-carboxamide?
4-amino-1-ethyl-N-(2-phenylcyclopropyl)pyrazole-5-carboxamide has a molecular weight of 270.34 g/mol, XLogP of 1.77, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-ethyl-N-(2-phenylcyclopropyl)pyrazole-5-carboxamide is sourced from PubChem (CID 65358906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).