1-amino-N-(5-tert-butyl-1H-pyrazol-3-yl)cyclopropane-1-carboxamide

C11H18N4O — CID 115976312

IUPAC1-amino-N-(5-tert-butyl-1H-pyrazol-3-yl)cyclopropane-1-carboxamide
SMILESCC(C)(C)c1cc(NC(=O)C2(N)CC2)n[nH]1
InChIInChI=1S/C11H18N4O/c1-10(2,3)7-6-8(15-14-7)13-9(16)11(12)4-5-11/h6H,4-5,12H2,1-3H3,(H2,13,14,15,16)
InChIKeySTWAXOUNEHCJFT-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.14
Rot. Bonds2

About 1-amino-N-(5-tert-butyl-1H-pyrazol-3-yl)cyclopropane-1-carboxamide

1-amino-N-(5-tert-butyl-1H-pyrazol-3-yl)cyclopropane-1-carboxamide (PubChem CID 115976312) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is 1-amino-N-(5-tert-butyl-1H-pyrazol-3-yl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-(5-tert-butyl-1H-pyrazol-3-yl)cyclopropane-1-carboxamide
PubChem CID115976312
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC Name1-amino-N-(5-tert-butyl-1H-pyrazol-3-yl)cyclopropane-1-carboxamide
SMILESCC(C)(C)c1cc(NC(=O)C2(N)CC2)n[nH]1
InChIInChI=1S/C11H18N4O/c1-10(2,3)7-6-8(15-14-7)13-9(16)11(12)4-5-11/h6H,4-5,12H2,1-3H3,(H2,13,14,15,16)
InChIKeySTWAXOUNEHCJFT-UHFFFAOYSA-N
XLogP1.14
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-(5-tert-butyl-1H-pyrazol-3-yl)oxolane-3-carboxamide
CID 104618529
1-amino-N-(5-methyl-1H-pyrazol-3-yl)cyclohexane-1-carboxamide
CID 63820608
3-amino-N-(5-tert-butyl-1H-pyrazol-3-yl)-3-methylbutanamide
CID 113433629
2-amino-N-(5-tert-butyl-1H-pyrazol-3-yl)-2-ethylbutanamide
CID 104618583
N-(5-tert-butyl-1H-pyrazol-3-yl)-2,3-dimethylbutanamide
CID 113235621
3-amino-N-(5-tert-butyl-1H-pyrazol-3-yl)-2-methylbutanamide
CID 104618654
2-[1-(aminomethyl)cyclobutyl]-N-(5-tert-butyl-1H-pyrazol-3-yl)acetamide
CID 104618585
N-(5-tert-butyl-1H-pyrazol-3-yl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 112696071
N-(5-tert-butyl-1H-pyrazol-3-yl)-2,2-dichloroacetamide
CID 13477003
1-amino-N-(5-propan-2-yl-1H-pyrazol-3-yl)cyclohexane-1-carboxamide
CID 113433584
ethyl 4-[(5-tert-butyl-1H-pyrazol-3-yl)amino]-4-oxobutanoate
CID 113226291
2-bromo-N-(5-tert-butyl-1H-pyrazol-3-yl)propanamide
CID 82110660

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(5-tert-butyl-1H-pyrazol-3-yl)cyclopropane-1-carboxamide?
The IUPAC name of 1-amino-N-(5-tert-butyl-1H-pyrazol-3-yl)cyclopropane-1-carboxamide (CID 115976312) is 1-amino-N-(5-tert-butyl-1H-pyrazol-3-yl)cyclopropane-1-carboxamide.
What is the SMILES notation for 1-amino-N-(5-tert-butyl-1H-pyrazol-3-yl)cyclopropane-1-carboxamide?
The canonical SMILES for 1-amino-N-(5-tert-butyl-1H-pyrazol-3-yl)cyclopropane-1-carboxamide is CC(C)(C)c1cc(NC(=O)C2(N)CC2)n[nH]1.
What is the InChIKey of 1-amino-N-(5-tert-butyl-1H-pyrazol-3-yl)cyclopropane-1-carboxamide?
The InChIKey is STWAXOUNEHCJFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-10(2,3)7-6-8(15-14-7)13-9(16)11(12)4-5-11/h6H,4-5,12H2,1-3H3,(H2,13,14,15,16).
What are the key properties of 1-amino-N-(5-tert-butyl-1H-pyrazol-3-yl)cyclopropane-1-carboxamide?
1-amino-N-(5-tert-butyl-1H-pyrazol-3-yl)cyclopropane-1-carboxamide has a molecular weight of 222.29 g/mol, XLogP of 1.14, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(5-tert-butyl-1H-pyrazol-3-yl)cyclopropane-1-carboxamide is sourced from PubChem (CID 115976312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).