3,5-dimethyl-1-propan-2-yl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine

C18H29N3 — CID 60931319

IUPAC3,5-dimethyl-1-propan-2-yl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine
SMILESCc1nn(C(C)C)c(C)c1NC1CC2CC1C1CCCC21
InChIInChI=1S/C18H29N3/c1-10(2)21-12(4)18(11(3)20-21)19-17-9-13-8-16(17)15-7-5-6-14(13)15/h10,13-17,19H,5-9H2,1-4H3
InChIKeyKKJOVGQASREXPI-UHFFFAOYSA-N
MW287.45 g/mol
LogP4.32
Rot. Bonds3

About 3,5-dimethyl-1-propan-2-yl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine

3,5-dimethyl-1-propan-2-yl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine (PubChem CID 60931319) has the molecular formula C18H29N3 and a molecular weight of 287.45 g/mol. Its IUPAC name is 3,5-dimethyl-1-propan-2-yl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine.

Molecular Properties

Compound Name3,5-dimethyl-1-propan-2-yl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine
PubChem CID60931319
Molecular FormulaC18H29N3
Molecular Weight287.45 g/mol
Exact Mass287.24
IUPAC Name3,5-dimethyl-1-propan-2-yl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine
SMILESCc1nn(C(C)C)c(C)c1NC1CC2CC1C1CCCC21
InChIInChI=1S/C18H29N3/c1-10(2)21-12(4)18(11(3)20-21)19-17-9-13-8-16(17)15-7-5-6-14(13)15/h10,13-17,19H,5-9H2,1-4H3
InChIKeyKKJOVGQASREXPI-UHFFFAOYSA-N
XLogP4.32
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.45
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3,5-dimethyl-1-propan-2-yl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine with MolForge

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Related Compounds

1,3,5-trimethyl-N-[4-(2-methylbutan-2-yl)cyclohexyl]pyrazol-4-amine
CID 28533715
N-(4-tert-butylcyclohexyl)-1,3,5-trimethylpyrazol-4-amine
CID 29543864
N-(2-tert-butylcyclohexyl)-1,3,5-trimethylpyrazol-4-amine
CID 43104717
1,3,5-trimethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)pyrazol-4-amine
CID 43109023
1-(2-bicyclo[2.2.1]heptanyl)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]ethanamine
CID 43181939
N-(2,6-dimethylcyclohexyl)-1,3,5-trimethylpyrazol-4-amine
CID 43204437
1,7,7-trimethyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]bicyclo[2.2.1]heptan-2-amine
CID 43223177
N-[1-(1,5-dimethylpyrazol-4-yl)ethyl]tricyclo[5.2.1.02,6]decan-8-amine
CID 43435516
1,3,5-trimethyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine
CID 43503215
3,5-dimethyl-N-(8-tricyclo[5.2.1.02,6]decanyl)-1H-pyrazol-4-amine
CID 43547385
N-[(1,3,5-trimethylpyrazol-4-yl)methyl]tricyclo[5.2.1.02,6]decan-8-amine
CID 43726679
N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]tricyclo[5.2.1.02,6]decan-8-amine
CID 43726759

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-1-propan-2-yl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine?
The IUPAC name of 3,5-dimethyl-1-propan-2-yl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine (CID 60931319) is 3,5-dimethyl-1-propan-2-yl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine.
What is the SMILES notation for 3,5-dimethyl-1-propan-2-yl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine?
The canonical SMILES for 3,5-dimethyl-1-propan-2-yl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine is Cc1nn(C(C)C)c(C)c1NC1CC2CC1C1CCCC21.
What is the InChIKey of 3,5-dimethyl-1-propan-2-yl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine?
The InChIKey is KKJOVGQASREXPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N3/c1-10(2)21-12(4)18(11(3)20-21)19-17-9-13-8-16(17)15-7-5-6-14(13)15/h10,13-17,19H,5-9H2,1-4H3.
What are the key properties of 3,5-dimethyl-1-propan-2-yl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine?
3,5-dimethyl-1-propan-2-yl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine has a molecular weight of 287.45 g/mol, XLogP of 4.32, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-1-propan-2-yl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine is sourced from PubChem (CID 60931319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).