N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]tricyclo[5.2.1.02,6]decan-8-amine

C16H24N2S — CID 43787360

IUPACN-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]tricyclo[5.2.1.02,6]decan-8-amine
SMILESCc1ncsc1C(C)NC1CC2CC1C1CCCC21
InChIInChI=1S/C16H24N2S/c1-9-16(19-8-17-9)10(2)18-15-7-11-6-14(15)13-5-3-4-12(11)13/h8,10-15,18H,3-7H2,1-2H3
InChIKeyKKBNKODPQJNAHM-UHFFFAOYSA-N
MW276.45 g/mol
LogP3.93
Rot. Bonds3

About N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]tricyclo[5.2.1.02,6]decan-8-amine

N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]tricyclo[5.2.1.02,6]decan-8-amine (PubChem CID 43787360) has the molecular formula C16H24N2S and a molecular weight of 276.45 g/mol. Its IUPAC name is N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]tricyclo[5.2.1.02,6]decan-8-amine.

Molecular Properties

Compound NameN-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]tricyclo[5.2.1.02,6]decan-8-amine
PubChem CID43787360
Molecular FormulaC16H24N2S
Molecular Weight276.45 g/mol
Exact Mass276.17
IUPAC NameN-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]tricyclo[5.2.1.02,6]decan-8-amine
SMILESCc1ncsc1C(C)NC1CC2CC1C1CCCC21
InChIInChI=1S/C16H24N2S/c1-9-16(19-8-17-9)10(2)18-15-7-11-6-14(15)13-5-3-4-12(11)13/h8,10-15,18H,3-7H2,1-2H3
InChIKeyKKBNKODPQJNAHM-UHFFFAOYSA-N
XLogP3.93
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.45
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]tricyclo[5.2.1.02,6]decan-8-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]tricyclo[5.2.1.02,6]decan-8-amine?
The IUPAC name of N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]tricyclo[5.2.1.02,6]decan-8-amine (CID 43787360) is N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]tricyclo[5.2.1.02,6]decan-8-amine.
What is the SMILES notation for N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]tricyclo[5.2.1.02,6]decan-8-amine?
The canonical SMILES for N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]tricyclo[5.2.1.02,6]decan-8-amine is Cc1ncsc1C(C)NC1CC2CC1C1CCCC21.
What is the InChIKey of N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]tricyclo[5.2.1.02,6]decan-8-amine?
The InChIKey is KKBNKODPQJNAHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2S/c1-9-16(19-8-17-9)10(2)18-15-7-11-6-14(15)13-5-3-4-12(11)13/h8,10-15,18H,3-7H2,1-2H3.
What are the key properties of N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]tricyclo[5.2.1.02,6]decan-8-amine?
N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]tricyclo[5.2.1.02,6]decan-8-amine has a molecular weight of 276.45 g/mol, XLogP of 3.93, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]tricyclo[5.2.1.02,6]decan-8-amine is sourced from PubChem (CID 43787360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).