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

C15H23N3 — CID 104955825

IUPAC1,3-dimethyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine
SMILESCc1nn(C)cc1NC1CC2CC1C1CCCC21
InChIInChI=1S/C15H23N3/c1-9-15(8-18(2)17-9)16-14-7-10-6-13(14)12-5-3-4-11(10)12/h8,10-14,16H,3-7H2,1-2H3
InChIKeyLMDGNBDNYYFVKN-UHFFFAOYSA-N
MW245.37 g/mol
LogP2.97
Rot. Bonds2

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

1,3-dimethyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine (PubChem CID 104955825) has the molecular formula C15H23N3 and a molecular weight of 245.37 g/mol. Its IUPAC name is 1,3-dimethyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine.

Molecular Properties

Compound Name1,3-dimethyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine
PubChem CID104955825
Molecular FormulaC15H23N3
Molecular Weight245.37 g/mol
Exact Mass245.19
IUPAC Name1,3-dimethyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine
SMILESCc1nn(C)cc1NC1CC2CC1C1CCCC21
InChIInChI=1S/C15H23N3/c1-9-15(8-18(2)17-9)16-14-7-10-6-13(14)12-5-3-4-11(10)12/h8,10-14,16H,3-7H2,1-2H3
InChIKeyLMDGNBDNYYFVKN-UHFFFAOYSA-N
XLogP2.97
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-cyclopropylcyclohexyl)-1,3-dimethylpyrazol-4-amine
CID 104955790
N-(1,3-dimethylpyrazol-4-yl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine
CID 102804021
N-(4-fluoro-2-methylphenyl)tricyclo[5.2.1.02,6]decan-8-amine
CID 43503196
1,3-dimethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)pyrazol-4-amine
CID 104955891
N-[(1-methyltriazol-4-yl)methyl]tricyclo[5.2.1.02,6]decan-8-amine
CID 62756684
5-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyridin-3-amine
CID 107584885
N-(cyclobutylmethyl)-1,3-dimethylpyrazol-4-amine
CID 102804461
1,3-dimethyl-N-(3-propan-2-ylcyclobutyl)pyrazol-4-amine
CID 103562440
1,3-dimethyl-N-(oxetan-3-yl)pyrazol-4-amine
CID 102804176
N-(2,6-dimethyloxan-4-yl)-1,3-dimethylpyrazol-4-amine
CID 104955922
N-(5-bromo-2,4-difluorophenyl)tricyclo[5.2.1.02,6]decan-8-amine
CID 102852658
N-(8-tricyclo[5.2.1.02,6]decanyl)-1,3,4-thiadiazol-2-amine
CID 107648835

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine?
The IUPAC name of 1,3-dimethyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine (CID 104955825) is 1,3-dimethyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine.
What is the SMILES notation for 1,3-dimethyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine?
The canonical SMILES for 1,3-dimethyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine is Cc1nn(C)cc1NC1CC2CC1C1CCCC21.
What is the InChIKey of 1,3-dimethyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine?
The InChIKey is LMDGNBDNYYFVKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3/c1-9-15(8-18(2)17-9)16-14-7-10-6-13(14)12-5-3-4-11(10)12/h8,10-14,16H,3-7H2,1-2H3.
What are the key properties of 1,3-dimethyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine?
1,3-dimethyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine has a molecular weight of 245.37 g/mol, XLogP of 2.97, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyrazol-4-amine is sourced from PubChem (CID 104955825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).