N,N-dipropyl-5-(trifluoromethyl)-1H-pyrazol-3-amine

C10H16F3N3 — CID 71062423

IUPACN,N-dipropyl-5-(trifluoromethyl)-1H-pyrazol-3-amine
SMILESCCCN(CCC)c1cc(C(F)(F)F)[nH]n1
InChIInChI=1S/C10H16F3N3/c1-3-5-16(6-4-2)9-7-8(14-15-9)10(11,12)13/h7H,3-6H2,1-2H3,(H,14,15)
InChIKeyHVUQWYZSEMCCNY-UHFFFAOYSA-N
MW235.25 g/mol
LogP3.05
Rot. Bonds5

About N,N-dipropyl-5-(trifluoromethyl)-1H-pyrazol-3-amine

N,N-dipropyl-5-(trifluoromethyl)-1H-pyrazol-3-amine (PubChem CID 71062423) has the molecular formula C10H16F3N3 and a molecular weight of 235.25 g/mol. Its IUPAC name is N,N-dipropyl-5-(trifluoromethyl)-1H-pyrazol-3-amine.

Molecular Properties

Compound NameN,N-dipropyl-5-(trifluoromethyl)-1H-pyrazol-3-amine
PubChem CID71062423
Molecular FormulaC10H16F3N3
Molecular Weight235.25 g/mol
Exact Mass235.13
IUPAC NameN,N-dipropyl-5-(trifluoromethyl)-1H-pyrazol-3-amine
SMILESCCCN(CCC)c1cc(C(F)(F)F)[nH]n1
InChIInChI=1S/C10H16F3N3/c1-3-5-16(6-4-2)9-7-8(14-15-9)10(11,12)13/h7H,3-6H2,1-2H3,(H,14,15)
InChIKeyHVUQWYZSEMCCNY-UHFFFAOYSA-N
XLogP3.05
TPSA31.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.25
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dipropyl-5-(trifluoromethyl)-1H-pyrazol-3-amine?
The IUPAC name of N,N-dipropyl-5-(trifluoromethyl)-1H-pyrazol-3-amine (CID 71062423) is N,N-dipropyl-5-(trifluoromethyl)-1H-pyrazol-3-amine.
What is the SMILES notation for N,N-dipropyl-5-(trifluoromethyl)-1H-pyrazol-3-amine?
The canonical SMILES for N,N-dipropyl-5-(trifluoromethyl)-1H-pyrazol-3-amine is CCCN(CCC)c1cc(C(F)(F)F)[nH]n1.
What is the InChIKey of N,N-dipropyl-5-(trifluoromethyl)-1H-pyrazol-3-amine?
The InChIKey is HVUQWYZSEMCCNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16F3N3/c1-3-5-16(6-4-2)9-7-8(14-15-9)10(11,12)13/h7H,3-6H2,1-2H3,(H,14,15).
What are the key properties of N,N-dipropyl-5-(trifluoromethyl)-1H-pyrazol-3-amine?
N,N-dipropyl-5-(trifluoromethyl)-1H-pyrazol-3-amine has a molecular weight of 235.25 g/mol, XLogP of 3.05, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dipropyl-5-(trifluoromethyl)-1H-pyrazol-3-amine is sourced from PubChem (CID 71062423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).