1-ethyl-N-(2-hydroxyethyl)pyrazole-3-carboxamide

C8H13N3O2 — CID 19262208

IUPAC1-ethyl-N-(2-hydroxyethyl)pyrazole-3-carboxamide
SMILESCCn1ccc(C(=O)NCCO)n1
InChIInChI=1S/C8H13N3O2/c1-2-11-5-3-7(10-11)8(13)9-4-6-12/h3,5,12H,2,4,6H2,1H3,(H,9,13)
InChIKeyRTWSLEMWZGSYIC-UHFFFAOYSA-N
MW183.21 g/mol
LogP-0.37
Rot. Bonds4

About 1-ethyl-N-(2-hydroxyethyl)pyrazole-3-carboxamide

1-ethyl-N-(2-hydroxyethyl)pyrazole-3-carboxamide (PubChem CID 19262208) has the molecular formula C8H13N3O2 and a molecular weight of 183.21 g/mol. Its IUPAC name is 1-ethyl-N-(2-hydroxyethyl)pyrazole-3-carboxamide.

Molecular Properties

Compound Name1-ethyl-N-(2-hydroxyethyl)pyrazole-3-carboxamide
PubChem CID19262208
Molecular FormulaC8H13N3O2
Molecular Weight183.21 g/mol
Exact Mass183.10
IUPAC Name1-ethyl-N-(2-hydroxyethyl)pyrazole-3-carboxamide
SMILESCCn1ccc(C(=O)NCCO)n1
InChIInChI=1S/C8H13N3O2/c1-2-11-5-3-7(10-11)8(13)9-4-6-12/h3,5,12H,2,4,6H2,1H3,(H,9,13)
InChIKeyRTWSLEMWZGSYIC-UHFFFAOYSA-N
XLogP-0.37
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.21
LogP ≤ 5-0.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N,1-diethylpyrazole-3-carboxamide
CID 19262384
N-(3-aminopropyl)-1-ethylpyrazole-3-carboxamide
CID 19621049
1-ethyl-N-prop-2-enylpyrazole-3-carboxamide
CID 19262174
1-ethyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyrazole-3-carboxamide
CID 91917578
N-(2-methoxyethyl)-1-(methoxymethyl)pyrazole-3-carboxamide
CID 19270943
1-ethyl-N-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethyl]pyrazole-3-carboxamide
CID 131943513
1-[(2,6-dichlorophenoxy)methyl]-N-(2-hydroxyethyl)pyrazole-3-carboxamide
CID 19269884
N-[[(1S)-2,2-dimethyl-1-phenylcyclopropyl]methyl]-1-ethylpyrazole-3-carboxamide
CID 125160202
4-amino-1-ethyl-N-(2-hydroxyethyl)pyrazole-3-carboxamide
CID 65359089
N-(5-chloro-2-methylphenyl)-1-ethylpyrazole-3-carboxamide
CID 19262159
N-(4-carbamoylphenyl)-1-ethylpyrazole-3-carboxamide
CID 6469151
1-ethyl-N-morpholin-4-ylpyrazole-3-carboxamide
CID 4771617

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-(2-hydroxyethyl)pyrazole-3-carboxamide?
The IUPAC name of 1-ethyl-N-(2-hydroxyethyl)pyrazole-3-carboxamide (CID 19262208) is 1-ethyl-N-(2-hydroxyethyl)pyrazole-3-carboxamide.
What is the SMILES notation for 1-ethyl-N-(2-hydroxyethyl)pyrazole-3-carboxamide?
The canonical SMILES for 1-ethyl-N-(2-hydroxyethyl)pyrazole-3-carboxamide is CCn1ccc(C(=O)NCCO)n1.
What is the InChIKey of 1-ethyl-N-(2-hydroxyethyl)pyrazole-3-carboxamide?
The InChIKey is RTWSLEMWZGSYIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O2/c1-2-11-5-3-7(10-11)8(13)9-4-6-12/h3,5,12H,2,4,6H2,1H3,(H,9,13).
What are the key properties of 1-ethyl-N-(2-hydroxyethyl)pyrazole-3-carboxamide?
1-ethyl-N-(2-hydroxyethyl)pyrazole-3-carboxamide has a molecular weight of 183.21 g/mol, XLogP of -0.37, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-(2-hydroxyethyl)pyrazole-3-carboxamide is sourced from PubChem (CID 19262208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).