2-methyl-N-[5-(trifluoromethyl)-1H-pyrazol-3-yl]cyclopropane-1-carboxamide

C9H10F3N3O — CID 71847753

IUPAC2-methyl-N-[5-(trifluoromethyl)-1H-pyrazol-3-yl]cyclopropane-1-carboxamide
SMILESCC1CC1C(=O)Nc1cc(C(F)(F)F)[nH]n1
InChIInChI=1S/C9H10F3N3O/c1-4-2-5(4)8(16)13-7-3-6(14-15-7)9(10,11)12/h3-5H,2H2,1H3,(H2,13,14,15,16)
InChIKeyZUUWTACKWLYTRM-UHFFFAOYSA-N
MW233.19 g/mol
LogP2.02
Rot. Bonds2

About 2-methyl-N-[5-(trifluoromethyl)-1H-pyrazol-3-yl]cyclopropane-1-carboxamide

2-methyl-N-[5-(trifluoromethyl)-1H-pyrazol-3-yl]cyclopropane-1-carboxamide (PubChem CID 71847753) has the molecular formula C9H10F3N3O and a molecular weight of 233.19 g/mol. Its IUPAC name is 2-methyl-N-[5-(trifluoromethyl)-1H-pyrazol-3-yl]cyclopropane-1-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[5-(trifluoromethyl)-1H-pyrazol-3-yl]cyclopropane-1-carboxamide
PubChem CID71847753
Molecular FormulaC9H10F3N3O
Molecular Weight233.19 g/mol
Exact Mass233.08
IUPAC Name2-methyl-N-[5-(trifluoromethyl)-1H-pyrazol-3-yl]cyclopropane-1-carboxamide
SMILESCC1CC1C(=O)Nc1cc(C(F)(F)F)[nH]n1
InChIInChI=1S/C9H10F3N3O/c1-4-2-5(4)8(16)13-7-3-6(14-15-7)9(10,11)12/h3-5H,2H2,1H3,(H2,13,14,15,16)
InChIKeyZUUWTACKWLYTRM-UHFFFAOYSA-N
XLogP2.02
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.19
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-cyclopropyl-1H-pyrazol-3-yl)butanamide
CID 5330972
Butanamide, N-(5-methyl-1H-pyrazol-3-yl)-
CID 5330971
3-Trifluoroacetylamino-5-methylpyrazole
CID 15312520
2-amino-N-[3-(trifluoromethyl)-1H-pyrazol-5-yl]propanamide
CID 75449519
N-[3-(trifluoromethyl)-1H-pyrazol-5-yl]-L-alaninamide
CID 97341571
N-(5-methyl-1H-pyrazol-3-yl)acetamide
CID 5246311
N-(5-cyclopropyl-1H-pyrazol-3-yl)acetamide
CID 2819087
5-methoxy-N-[5-(trifluoromethyl)-1H-pyrazol-3-yl]pentanamide
CID 71847755
N-[3-(trifluoromethyl)-1H-pyrazol-5-yl]acetamide
CID 86717284
3-Methacroylamino-5-methylpyrazole
CID 15312519
3-methyl-N-(5-propan-2-yl-1H-pyrazol-3-yl)butanamide
CID 47404991
4,4,4-trifluoro-N-[5-(2-methylpropyl)-1H-pyrazol-3-yl]butanamide
CID 75374688

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[5-(trifluoromethyl)-1H-pyrazol-3-yl]cyclopropane-1-carboxamide?
The IUPAC name of 2-methyl-N-[5-(trifluoromethyl)-1H-pyrazol-3-yl]cyclopropane-1-carboxamide (CID 71847753) is 2-methyl-N-[5-(trifluoromethyl)-1H-pyrazol-3-yl]cyclopropane-1-carboxamide.
What is the SMILES notation for 2-methyl-N-[5-(trifluoromethyl)-1H-pyrazol-3-yl]cyclopropane-1-carboxamide?
The canonical SMILES for 2-methyl-N-[5-(trifluoromethyl)-1H-pyrazol-3-yl]cyclopropane-1-carboxamide is CC1CC1C(=O)Nc1cc(C(F)(F)F)[nH]n1.
What is the InChIKey of 2-methyl-N-[5-(trifluoromethyl)-1H-pyrazol-3-yl]cyclopropane-1-carboxamide?
The InChIKey is ZUUWTACKWLYTRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10F3N3O/c1-4-2-5(4)8(16)13-7-3-6(14-15-7)9(10,11)12/h3-5H,2H2,1H3,(H2,13,14,15,16).
What are the key properties of 2-methyl-N-[5-(trifluoromethyl)-1H-pyrazol-3-yl]cyclopropane-1-carboxamide?
2-methyl-N-[5-(trifluoromethyl)-1H-pyrazol-3-yl]cyclopropane-1-carboxamide has a molecular weight of 233.19 g/mol, XLogP of 2.02, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[5-(trifluoromethyl)-1H-pyrazol-3-yl]cyclopropane-1-carboxamide is sourced from PubChem (CID 71847753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).