N-(1-cyclopropylethyl)-1-(2,2-difluoroethyl)pyrazol-3-amine

C10H15F2N3 — CID 115921006

IUPACN-(1-cyclopropylethyl)-1-(2,2-difluoroethyl)pyrazol-3-amine
SMILESCC(Nc1ccn(CC(F)F)n1)C1CC1
InChIInChI=1S/C10H15F2N3/c1-7(8-2-3-8)13-10-4-5-15(14-10)6-9(11)12/h4-5,7-9H,2-3,6H2,1H3,(H,13,14)
InChIKeyGLPUBSDLSMCNHH-UHFFFAOYSA-N
MW215.25 g/mol
LogP2.36
Rot. Bonds5

About N-(1-cyclopropylethyl)-1-(2,2-difluoroethyl)pyrazol-3-amine

N-(1-cyclopropylethyl)-1-(2,2-difluoroethyl)pyrazol-3-amine (PubChem CID 115921006) has the molecular formula C10H15F2N3 and a molecular weight of 215.25 g/mol. Its IUPAC name is N-(1-cyclopropylethyl)-1-(2,2-difluoroethyl)pyrazol-3-amine.

Molecular Properties

Compound NameN-(1-cyclopropylethyl)-1-(2,2-difluoroethyl)pyrazol-3-amine
PubChem CID115921006
Molecular FormulaC10H15F2N3
Molecular Weight215.25 g/mol
Exact Mass215.12
IUPAC NameN-(1-cyclopropylethyl)-1-(2,2-difluoroethyl)pyrazol-3-amine
SMILESCC(Nc1ccn(CC(F)F)n1)C1CC1
InChIInChI=1S/C10H15F2N3/c1-7(8-2-3-8)13-10-4-5-15(14-10)6-9(11)12/h4-5,7-9H,2-3,6H2,1H3,(H,13,14)
InChIKeyGLPUBSDLSMCNHH-UHFFFAOYSA-N
XLogP2.36
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1-Cyclopropylethyl)-1H-pyrazol-5-amine
CID 3782762
N-ethyl-1-methyl-1H-pyrazol-3-amine
CID 60809330
N-methyl-1-(propan-2-yl)-1H-pyrazol-5-amine
CID 63090550
1-(3-Methylbutan-2-yl)-1H-pyrazol-5-amine
CID 16782262
1-(Pentan-2-yl)-1H-pyrazol-5-amine
CID 20115629
1-(2,2-difluorocyclopropyl)-1H-pyrazol-5-amine hydrochloride
CID 138046199
1-(3-Methylbutyl)-1H-pyrazol-5-amine
CID 13560438
5-Cyclopropyl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine
CID 4767315
1-(2,2-difluoroethyl)-N-pentan-3-ylpyrazol-3-amine
CID 75483532
1-methyl-N-[1-(3-methylbutyl)pyrazol-3-yl]piperidin-4-amine
CID 75483546
1-(2,2-difluoroethyl)-N-[(1S)-1-(1-methylpiperidin-4-yl)ethyl]pyrazol-3-amine
CID 97797578
1-[1-(4-Cyanobutan-2-yl)pyrazol-3-yl]-2-(2,2,2-trifluoroethyl)guanidine
CID 20451294

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylethyl)-1-(2,2-difluoroethyl)pyrazol-3-amine?
The IUPAC name of N-(1-cyclopropylethyl)-1-(2,2-difluoroethyl)pyrazol-3-amine (CID 115921006) is N-(1-cyclopropylethyl)-1-(2,2-difluoroethyl)pyrazol-3-amine.
What is the SMILES notation for N-(1-cyclopropylethyl)-1-(2,2-difluoroethyl)pyrazol-3-amine?
The canonical SMILES for N-(1-cyclopropylethyl)-1-(2,2-difluoroethyl)pyrazol-3-amine is CC(Nc1ccn(CC(F)F)n1)C1CC1.
What is the InChIKey of N-(1-cyclopropylethyl)-1-(2,2-difluoroethyl)pyrazol-3-amine?
The InChIKey is GLPUBSDLSMCNHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15F2N3/c1-7(8-2-3-8)13-10-4-5-15(14-10)6-9(11)12/h4-5,7-9H,2-3,6H2,1H3,(H,13,14).
What are the key properties of N-(1-cyclopropylethyl)-1-(2,2-difluoroethyl)pyrazol-3-amine?
N-(1-cyclopropylethyl)-1-(2,2-difluoroethyl)pyrazol-3-amine has a molecular weight of 215.25 g/mol, XLogP of 2.36, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylethyl)-1-(2,2-difluoroethyl)pyrazol-3-amine is sourced from PubChem (CID 115921006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).