4-amino-N-cyclopropyl-5-ethyl-N-(2-methoxyethyl)-1H-pyrazole-3-carboxamide

C12H20N4O2 — CID 55034194

IUPAC4-amino-N-cyclopropyl-5-ethyl-N-(2-methoxyethyl)-1H-pyrazole-3-carboxamide
SMILESCCc1[nH]nc(C(=O)N(CCOC)C2CC2)c1N
InChIInChI=1S/C12H20N4O2/c1-3-9-10(13)11(15-14-9)12(17)16(6-7-18-2)8-4-5-8/h8H,3-7,13H2,1-2H3,(H,14,15)
InChIKeyBDSSHMSLVXORDA-UHFFFAOYSA-N
MW252.32 g/mol
LogP0.81
Rot. Bonds6

About 4-amino-N-cyclopropyl-5-ethyl-N-(2-methoxyethyl)-1H-pyrazole-3-carboxamide

4-amino-N-cyclopropyl-5-ethyl-N-(2-methoxyethyl)-1H-pyrazole-3-carboxamide (PubChem CID 55034194) has the molecular formula C12H20N4O2 and a molecular weight of 252.32 g/mol. Its IUPAC name is 4-amino-N-cyclopropyl-5-ethyl-N-(2-methoxyethyl)-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-cyclopropyl-5-ethyl-N-(2-methoxyethyl)-1H-pyrazole-3-carboxamide
PubChem CID55034194
Molecular FormulaC12H20N4O2
Molecular Weight252.32 g/mol
Exact Mass252.16
IUPAC Name4-amino-N-cyclopropyl-5-ethyl-N-(2-methoxyethyl)-1H-pyrazole-3-carboxamide
SMILESCCc1[nH]nc(C(=O)N(CCOC)C2CC2)c1N
InChIInChI=1S/C12H20N4O2/c1-3-9-10(13)11(15-14-9)12(17)16(6-7-18-2)8-4-5-8/h8H,3-7,13H2,1-2H3,(H,14,15)
InChIKeyBDSSHMSLVXORDA-UHFFFAOYSA-N
XLogP0.81
TPSA84.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-(2-cyanoethyl)-N-cyclopropyl-5-ethyl-1H-pyrazole-3-carboxamide
CID 55034385
4-amino-5-ethyl-N-(2-methoxyethyl)-N-pentan-3-yl-1H-pyrazole-3-carboxamide
CID 62081656
4-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-5-ethyl-1H-pyrazole-3-carboxamide
CID 62082354
4-amino-N-benzyl-N-cyclopropyl-5-ethyl-1H-pyrazole-3-carboxamide
CID 62081458
3-amino-N-cyclopropyl-N-(2-methoxyethyl)-5-methyl-1H-pyrazole-4-carboxamide
CID 54947240
N-cyclopropyl-N-(2-methoxyethyl)-5-methyl-4-sulfamoyl-1H-pyrazole-3-carboxamide
CID 65386491
4-amino-N-cyclopropyl-5-ethyl-N-[(1-methylimidazol-2-yl)methyl]-1H-pyrazole-3-carboxamide
CID 62082526
4-amino-N-cyclobutyl-N-(3-hydroxypropyl)-5-propyl-1H-pyrazole-3-carboxamide
CID 102858736
N-cyclopropyl-5-ethyl-N-propyl-4-sulfamoyl-1H-pyrazole-3-carboxamide
CID 65389094
methyl 2-[(4-amino-5-ethyl-1H-pyrazole-3-carbonyl)-(2-methoxy-2-oxoethyl)amino]acetate
CID 62955204
4-amino-N-cyclopropyl-1-ethyl-N-(2-methoxyethyl)pyrazole-3-carboxamide
CID 65357909
4-amino-N-[2-(dimethylamino)ethyl]-5-ethyl-N-methyl-1H-pyrazole-3-carboxamide
CID 63694755

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-cyclopropyl-5-ethyl-N-(2-methoxyethyl)-1H-pyrazole-3-carboxamide?
The IUPAC name of 4-amino-N-cyclopropyl-5-ethyl-N-(2-methoxyethyl)-1H-pyrazole-3-carboxamide (CID 55034194) is 4-amino-N-cyclopropyl-5-ethyl-N-(2-methoxyethyl)-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-N-cyclopropyl-5-ethyl-N-(2-methoxyethyl)-1H-pyrazole-3-carboxamide?
The canonical SMILES for 4-amino-N-cyclopropyl-5-ethyl-N-(2-methoxyethyl)-1H-pyrazole-3-carboxamide is CCc1[nH]nc(C(=O)N(CCOC)C2CC2)c1N.
What is the InChIKey of 4-amino-N-cyclopropyl-5-ethyl-N-(2-methoxyethyl)-1H-pyrazole-3-carboxamide?
The InChIKey is BDSSHMSLVXORDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O2/c1-3-9-10(13)11(15-14-9)12(17)16(6-7-18-2)8-4-5-8/h8H,3-7,13H2,1-2H3,(H,14,15).
What are the key properties of 4-amino-N-cyclopropyl-5-ethyl-N-(2-methoxyethyl)-1H-pyrazole-3-carboxamide?
4-amino-N-cyclopropyl-5-ethyl-N-(2-methoxyethyl)-1H-pyrazole-3-carboxamide has a molecular weight of 252.32 g/mol, XLogP of 0.81, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-cyclopropyl-5-ethyl-N-(2-methoxyethyl)-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 55034194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).