N-ethyl-N-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]cyclopropanecarboxamide

C14H23N3O — CID 46396678

IUPACN-ethyl-N-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]cyclopropanecarboxamide
SMILESCCN(Cc1c(C)nn(CC)c1C)C(=O)C1CC1
InChIInChI=1S/C14H23N3O/c1-5-16(14(18)12-7-8-12)9-13-10(3)15-17(6-2)11(13)4/h12H,5-9H2,1-4H3
InChIKeyAZZMZEWCWOLBSC-UHFFFAOYSA-N
MW249.36 g/mol
LogP2.28
Rot. Bonds5

About N-ethyl-N-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]cyclopropanecarboxamide

N-ethyl-N-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]cyclopropanecarboxamide (PubChem CID 46396678) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is N-ethyl-N-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-ethyl-N-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]cyclopropanecarboxamide
PubChem CID46396678
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC NameN-ethyl-N-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]cyclopropanecarboxamide
SMILESCCN(Cc1c(C)nn(CC)c1C)C(=O)C1CC1
InChIInChI=1S/C14H23N3O/c1-5-16(14(18)12-7-8-12)9-13-10(3)15-17(6-2)11(13)4/h12H,5-9H2,1-4H3
InChIKeyAZZMZEWCWOLBSC-UHFFFAOYSA-N
XLogP2.28
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 52.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]cyclopropanecarboxamide?
The IUPAC name of N-ethyl-N-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]cyclopropanecarboxamide (CID 46396678) is N-ethyl-N-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]cyclopropanecarboxamide.
What is the SMILES notation for N-ethyl-N-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]cyclopropanecarboxamide?
The canonical SMILES for N-ethyl-N-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]cyclopropanecarboxamide is CCN(Cc1c(C)nn(CC)c1C)C(=O)C1CC1.
What is the InChIKey of N-ethyl-N-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]cyclopropanecarboxamide?
The InChIKey is AZZMZEWCWOLBSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-5-16(14(18)12-7-8-12)9-13-10(3)15-17(6-2)11(13)4/h12H,5-9H2,1-4H3.
What are the key properties of N-ethyl-N-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]cyclopropanecarboxamide?
N-ethyl-N-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]cyclopropanecarboxamide has a molecular weight of 249.36 g/mol, XLogP of 2.28, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]cyclopropanecarboxamide is sourced from PubChem (CID 46396678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).