4-amino-N-cyclopropyl-5-ethyl-N-[(1-methylimidazol-2-yl)methyl]-1H-pyrazole-3-carboxamide

C14H20N6O — CID 62082526

IUPAC4-amino-N-cyclopropyl-5-ethyl-N-[(1-methylimidazol-2-yl)methyl]-1H-pyrazole-3-carboxamide
SMILESCCc1[nH]nc(C(=O)N(Cc2nccn2C)C2CC2)c1N
InChIInChI=1S/C14H20N6O/c1-3-10-12(15)13(18-17-10)14(21)20(9-4-5-9)8-11-16-6-7-19(11)2/h6-7,9H,3-5,8,15H2,1-2H3,(H,17,18)
InChIKeyZYUJOMFVALOZTQ-UHFFFAOYSA-N
MW288.36 g/mol
LogP1.09
Rot. Bonds5

About 4-amino-N-cyclopropyl-5-ethyl-N-[(1-methylimidazol-2-yl)methyl]-1H-pyrazole-3-carboxamide

4-amino-N-cyclopropyl-5-ethyl-N-[(1-methylimidazol-2-yl)methyl]-1H-pyrazole-3-carboxamide (PubChem CID 62082526) has the molecular formula C14H20N6O and a molecular weight of 288.36 g/mol. Its IUPAC name is 4-amino-N-cyclopropyl-5-ethyl-N-[(1-methylimidazol-2-yl)methyl]-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-cyclopropyl-5-ethyl-N-[(1-methylimidazol-2-yl)methyl]-1H-pyrazole-3-carboxamide
PubChem CID62082526
Molecular FormulaC14H20N6O
Molecular Weight288.36 g/mol
Exact Mass288.17
IUPAC Name4-amino-N-cyclopropyl-5-ethyl-N-[(1-methylimidazol-2-yl)methyl]-1H-pyrazole-3-carboxamide
SMILESCCc1[nH]nc(C(=O)N(Cc2nccn2C)C2CC2)c1N
InChIInChI=1S/C14H20N6O/c1-3-10-12(15)13(18-17-10)14(21)20(9-4-5-9)8-11-16-6-7-19(11)2/h6-7,9H,3-5,8,15H2,1-2H3,(H,17,18)
InChIKeyZYUJOMFVALOZTQ-UHFFFAOYSA-N
XLogP1.09
TPSA92.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.36
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-amino-N-benzyl-N-cyclopropyl-5-ethyl-1H-pyrazole-3-carboxamide
CID 62081458
N-cyclopropyl-3,5-dimethyl-N-[(1-methylimidazol-2-yl)methyl]-1H-pyrazole-4-carboxamide
CID 60959154
3,5-dibromo-N-cyclopropyl-N-[(1-methylimidazol-2-yl)methyl]benzamide
CID 103907950
2-amino-N-cyclopropyl-2-ethyl-N-[(1-methylimidazol-2-yl)methyl]butanamide
CID 79813594
3-amino-N-cyclopropyl-N-[(1-methylimidazol-2-yl)methyl]benzamide
CID 60946346
4-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-5-ethyl-1H-pyrazole-3-carboxamide
CID 62082354
3-amino-N-cyclopropyl-4-methyl-N-[(1-methylimidazol-2-yl)methyl]benzamide
CID 60946703
3-amino-N-cyclopropyl-2-methyl-N-[(1-methylimidazol-2-yl)methyl]benzamide
CID 61108887
N-cyclopropyl-5-methyl-N-[(1-methylimidazol-2-yl)methyl]-1,2-oxazole-3-carboxamide
CID 3710721
N-cyclopropyl-6-fluoro-N-[(1-methylimidazol-2-yl)methyl]pyridine-3-carboxamide
CID 63977624
2-amino-N-cyclopropyl-4-methyl-N-[(1-methylimidazol-2-yl)methyl]pentanamide
CID 54871592
3-amino-N-cyclopropyl-3-methyl-N-[(1-methylimidazol-2-yl)methyl]butanamide
CID 64677936

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-cyclopropyl-5-ethyl-N-[(1-methylimidazol-2-yl)methyl]-1H-pyrazole-3-carboxamide?
The IUPAC name of 4-amino-N-cyclopropyl-5-ethyl-N-[(1-methylimidazol-2-yl)methyl]-1H-pyrazole-3-carboxamide (CID 62082526) is 4-amino-N-cyclopropyl-5-ethyl-N-[(1-methylimidazol-2-yl)methyl]-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-N-cyclopropyl-5-ethyl-N-[(1-methylimidazol-2-yl)methyl]-1H-pyrazole-3-carboxamide?
The canonical SMILES for 4-amino-N-cyclopropyl-5-ethyl-N-[(1-methylimidazol-2-yl)methyl]-1H-pyrazole-3-carboxamide is CCc1[nH]nc(C(=O)N(Cc2nccn2C)C2CC2)c1N.
What is the InChIKey of 4-amino-N-cyclopropyl-5-ethyl-N-[(1-methylimidazol-2-yl)methyl]-1H-pyrazole-3-carboxamide?
The InChIKey is ZYUJOMFVALOZTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N6O/c1-3-10-12(15)13(18-17-10)14(21)20(9-4-5-9)8-11-16-6-7-19(11)2/h6-7,9H,3-5,8,15H2,1-2H3,(H,17,18).
What are the key properties of 4-amino-N-cyclopropyl-5-ethyl-N-[(1-methylimidazol-2-yl)methyl]-1H-pyrazole-3-carboxamide?
4-amino-N-cyclopropyl-5-ethyl-N-[(1-methylimidazol-2-yl)methyl]-1H-pyrazole-3-carboxamide has a molecular weight of 288.36 g/mol, XLogP of 1.09, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-cyclopropyl-5-ethyl-N-[(1-methylimidazol-2-yl)methyl]-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 62082526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).