4-amino-N-benzyl-N-cyclopropyl-5-ethyl-1H-pyrazole-3-carboxamide

C16H20N4O — CID 62081458

IUPAC4-amino-N-benzyl-N-cyclopropyl-5-ethyl-1H-pyrazole-3-carboxamide
SMILESCCc1[nH]nc(C(=O)N(Cc2ccccc2)C2CC2)c1N
InChIInChI=1S/C16H20N4O/c1-2-13-14(17)15(19-18-13)16(21)20(12-8-9-12)10-11-6-4-3-5-7-11/h3-7,12H,2,8-10,17H2,1H3,(H,18,19)
InChIKeyZDSKNXOQWLGWQF-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.36
Rot. Bonds5

About 4-amino-N-benzyl-N-cyclopropyl-5-ethyl-1H-pyrazole-3-carboxamide

4-amino-N-benzyl-N-cyclopropyl-5-ethyl-1H-pyrazole-3-carboxamide (PubChem CID 62081458) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is 4-amino-N-benzyl-N-cyclopropyl-5-ethyl-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-benzyl-N-cyclopropyl-5-ethyl-1H-pyrazole-3-carboxamide
PubChem CID62081458
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC Name4-amino-N-benzyl-N-cyclopropyl-5-ethyl-1H-pyrazole-3-carboxamide
SMILESCCc1[nH]nc(C(=O)N(Cc2ccccc2)C2CC2)c1N
InChIInChI=1S/C16H20N4O/c1-2-13-14(17)15(19-18-13)16(21)20(12-8-9-12)10-11-6-4-3-5-7-11/h3-7,12H,2,8-10,17H2,1H3,(H,18,19)
InChIKeyZDSKNXOQWLGWQF-UHFFFAOYSA-N
XLogP2.36
TPSA75.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-cyclopropyl-5-ethyl-N-[(1-methylimidazol-2-yl)methyl]-1H-pyrazole-3-carboxamide
CID 62082526
4-amino-N-cyclopropyl-5-ethyl-N-(2-methoxyethyl)-1H-pyrazole-3-carboxamide
CID 55034194
4-amino-N-(2-cyanoethyl)-N-cyclopropyl-5-ethyl-1H-pyrazole-3-carboxamide
CID 55034385
4-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-5-ethyl-1H-pyrazole-3-carboxamide
CID 62082354
3-amino-N-cyclopropyl-N-[(4-ethylphenyl)methyl]-1H-1,2,4-triazole-5-carboxamide
CID 62794697
4-amino-N,5-diethyl-N-[(2-methylphenyl)methyl]-1H-pyrazole-3-carboxamide
CID 62082868
2-amino-N-benzyl-N-cyclopropyl-3-fluorobenzamide
CID 81499537
N-benzyl-N-cyclopropyl-5-methyl-1H-pyrazole-4-carboxamide
CID 63999824
4-amino-N-methyl-N-(2-phenylethyl)-5-propyl-1H-pyrazole-3-carboxamide
CID 62076132
N-benzyl-2-bromo-N-cyclopropylbutanamide
CID 62856125
4-amino-N-benzyl-N-cyclopropyl-1-ethylpyrazole-5-carboxamide
CID 65357630
1-benzyl-1-cyclopropyl-3-ethylurea
CID 127578302

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-benzyl-N-cyclopropyl-5-ethyl-1H-pyrazole-3-carboxamide?
The IUPAC name of 4-amino-N-benzyl-N-cyclopropyl-5-ethyl-1H-pyrazole-3-carboxamide (CID 62081458) is 4-amino-N-benzyl-N-cyclopropyl-5-ethyl-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-N-benzyl-N-cyclopropyl-5-ethyl-1H-pyrazole-3-carboxamide?
The canonical SMILES for 4-amino-N-benzyl-N-cyclopropyl-5-ethyl-1H-pyrazole-3-carboxamide is CCc1[nH]nc(C(=O)N(Cc2ccccc2)C2CC2)c1N.
What is the InChIKey of 4-amino-N-benzyl-N-cyclopropyl-5-ethyl-1H-pyrazole-3-carboxamide?
The InChIKey is ZDSKNXOQWLGWQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O/c1-2-13-14(17)15(19-18-13)16(21)20(12-8-9-12)10-11-6-4-3-5-7-11/h3-7,12H,2,8-10,17H2,1H3,(H,18,19).
What are the key properties of 4-amino-N-benzyl-N-cyclopropyl-5-ethyl-1H-pyrazole-3-carboxamide?
4-amino-N-benzyl-N-cyclopropyl-5-ethyl-1H-pyrazole-3-carboxamide has a molecular weight of 284.36 g/mol, XLogP of 2.36, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-benzyl-N-cyclopropyl-5-ethyl-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 62081458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).