1,3,5-trimethyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine

C16H25N3 — CID 43503215

IUPAC1,3,5-trimethyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine
SMILESCc1nn(C)c(C)c1NC1CC2CC1C1CCCC21
InChIInChI=1S/C16H25N3/c1-9-16(10(2)19(3)18-9)17-15-8-11-7-14(15)13-6-4-5-12(11)13/h11-15,17H,4-8H2,1-3H3
InChIKeyLOZUQVNRUKGLME-UHFFFAOYSA-N
MW259.40 g/mol
LogP3.27
Rot. Bonds2

About 1,3,5-trimethyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine

1,3,5-trimethyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine (PubChem CID 43503215) has the molecular formula C16H25N3 and a molecular weight of 259.40 g/mol. Its IUPAC name is 1,3,5-trimethyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine.

Molecular Properties

Compound Name1,3,5-trimethyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine
PubChem CID43503215
Molecular FormulaC16H25N3
Molecular Weight259.40 g/mol
Exact Mass259.20
IUPAC Name1,3,5-trimethyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine
SMILESCc1nn(C)c(C)c1NC1CC2CC1C1CCCC21
InChIInChI=1S/C16H25N3/c1-9-16(10(2)19(3)18-9)17-15-8-11-7-14(15)13-6-4-5-12(11)13/h11-15,17H,4-8H2,1-3H3
InChIKeyLOZUQVNRUKGLME-UHFFFAOYSA-N
XLogP3.27
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.40
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,3,5-trimethyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine?
The IUPAC name of 1,3,5-trimethyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine (CID 43503215) is 1,3,5-trimethyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine.
What is the SMILES notation for 1,3,5-trimethyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine?
The canonical SMILES for 1,3,5-trimethyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine is Cc1nn(C)c(C)c1NC1CC2CC1C1CCCC21.
What is the InChIKey of 1,3,5-trimethyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine?
The InChIKey is LOZUQVNRUKGLME-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3/c1-9-16(10(2)19(3)18-9)17-15-8-11-7-14(15)13-6-4-5-12(11)13/h11-15,17H,4-8H2,1-3H3.
What are the key properties of 1,3,5-trimethyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine?
1,3,5-trimethyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine has a molecular weight of 259.40 g/mol, XLogP of 3.27, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,5-trimethyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine is sourced from PubChem (CID 43503215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).