N-[2-(1-cyclopropyl-5-methylimidazol-2-yl)ethyl]-2-ethylpyrazole-3-carboxamide

C15H21N5O — CID 91923840

IUPACN-[2-(1-cyclopropyl-5-methylimidazol-2-yl)ethyl]-2-ethylpyrazole-3-carboxamide
SMILESCCn1nccc1C(=O)NCCc1ncc(C)n1C1CC1
InChIInChI=1S/C15H21N5O/c1-3-19-13(6-9-18-19)15(21)16-8-7-14-17-10-11(2)20(14)12-4-5-12/h6,9-10,12H,3-5,7-8H2,1-2H3,(H,16,21)
InChIKeyKLCHMOZETXKYIZ-UHFFFAOYSA-N
MW287.37 g/mol
LogP1.72
Rot. Bonds6

About N-[2-(1-cyclopropyl-5-methylimidazol-2-yl)ethyl]-2-ethylpyrazole-3-carboxamide

N-[2-(1-cyclopropyl-5-methylimidazol-2-yl)ethyl]-2-ethylpyrazole-3-carboxamide (PubChem CID 91923840) has the molecular formula C15H21N5O and a molecular weight of 287.37 g/mol. Its IUPAC name is N-[2-(1-cyclopropyl-5-methylimidazol-2-yl)ethyl]-2-ethylpyrazole-3-carboxamide.

Molecular Properties

Compound NameN-[2-(1-cyclopropyl-5-methylimidazol-2-yl)ethyl]-2-ethylpyrazole-3-carboxamide
PubChem CID91923840
Molecular FormulaC15H21N5O
Molecular Weight287.37 g/mol
Exact Mass287.17
IUPAC NameN-[2-(1-cyclopropyl-5-methylimidazol-2-yl)ethyl]-2-ethylpyrazole-3-carboxamide
SMILESCCn1nccc1C(=O)NCCc1ncc(C)n1C1CC1
InChIInChI=1S/C15H21N5O/c1-3-19-13(6-9-18-19)15(21)16-8-7-14-17-10-11(2)20(14)12-4-5-12/h6,9-10,12H,3-5,7-8H2,1-2H3,(H,16,21)
InChIKeyKLCHMOZETXKYIZ-UHFFFAOYSA-N
XLogP1.72
TPSA64.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.37
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-(1-cyclopropyl-5-methylimidazol-2-yl)ethyl]-2-ethylpyrazole-3-carboxamide?
The IUPAC name of N-[2-(1-cyclopropyl-5-methylimidazol-2-yl)ethyl]-2-ethylpyrazole-3-carboxamide (CID 91923840) is N-[2-(1-cyclopropyl-5-methylimidazol-2-yl)ethyl]-2-ethylpyrazole-3-carboxamide.
What is the SMILES notation for N-[2-(1-cyclopropyl-5-methylimidazol-2-yl)ethyl]-2-ethylpyrazole-3-carboxamide?
The canonical SMILES for N-[2-(1-cyclopropyl-5-methylimidazol-2-yl)ethyl]-2-ethylpyrazole-3-carboxamide is CCn1nccc1C(=O)NCCc1ncc(C)n1C1CC1.
What is the InChIKey of N-[2-(1-cyclopropyl-5-methylimidazol-2-yl)ethyl]-2-ethylpyrazole-3-carboxamide?
The InChIKey is KLCHMOZETXKYIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O/c1-3-19-13(6-9-18-19)15(21)16-8-7-14-17-10-11(2)20(14)12-4-5-12/h6,9-10,12H,3-5,7-8H2,1-2H3,(H,16,21).
What are the key properties of N-[2-(1-cyclopropyl-5-methylimidazol-2-yl)ethyl]-2-ethylpyrazole-3-carboxamide?
N-[2-(1-cyclopropyl-5-methylimidazol-2-yl)ethyl]-2-ethylpyrazole-3-carboxamide has a molecular weight of 287.37 g/mol, XLogP of 1.72, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-cyclopropyl-5-methylimidazol-2-yl)ethyl]-2-ethylpyrazole-3-carboxamide is sourced from PubChem (CID 91923840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).