2-(2-methylphenyl)-1-(3-tricyclo[3.2.1.02,4]octanyl)ethanamine

C17H23N — CID 114097065

IUPAC2-(2-methylphenyl)-1-(3-tricyclo[3.2.1.02,4]octanyl)ethanamine
SMILESCc1ccccc1CC(N)C1C2C3CCC(C3)C12
InChIInChI=1S/C17H23N/c1-10-4-2-3-5-11(10)9-14(18)17-15-12-6-7-13(8-12)16(15)17/h2-5,12-17H,6-9,18H2,1H3
InChIKeyKRSAEVLAVOLULU-UHFFFAOYSA-N
MW241.38 g/mol
LogP3.16
Rot. Bonds3

About 2-(2-methylphenyl)-1-(3-tricyclo[3.2.1.02,4]octanyl)ethanamine

2-(2-methylphenyl)-1-(3-tricyclo[3.2.1.02,4]octanyl)ethanamine (PubChem CID 114097065) has the molecular formula C17H23N and a molecular weight of 241.38 g/mol. Its IUPAC name is 2-(2-methylphenyl)-1-(3-tricyclo[3.2.1.02,4]octanyl)ethanamine.

Molecular Properties

Compound Name2-(2-methylphenyl)-1-(3-tricyclo[3.2.1.02,4]octanyl)ethanamine
PubChem CID114097065
Molecular FormulaC17H23N
Molecular Weight241.38 g/mol
Exact Mass241.18
IUPAC Name2-(2-methylphenyl)-1-(3-tricyclo[3.2.1.02,4]octanyl)ethanamine
SMILESCc1ccccc1CC(N)C1C2C3CCC(C3)C12
InChIInChI=1S/C17H23N/c1-10-4-2-3-5-11(10)9-14(18)17-15-12-6-7-13(8-12)16(15)17/h2-5,12-17H,6-9,18H2,1H3
InChIKeyKRSAEVLAVOLULU-UHFFFAOYSA-N
XLogP3.16
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-(2-methylphenyl)-1-(3-tricyclo[3.2.1.02,4]octanyl)ethanamine with MolForge

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

Launch Full Analysis

Related Compounds

N-[(2-methylphenyl)methyl]tricyclo[3.2.1.02,4]octan-3-amine
CID 114095751
1-(4-butylcyclohexyl)-2-(2-methylphenyl)ethanamine
CID 63528058
1-(4-methylmorpholin-2-yl)-2-(2-methylphenyl)ethanamine
CID 79093432
1-(1,4-diazabicyclo[2.2.2]octan-2-yl)-2-(2-methylphenyl)ethanamine
CID 79974405
methane;1-methyl-2-(2-methylpropyl)benzene
CID 142148493
1-(2-chloro-2-cyclopropylethyl)-2-methylbenzene
CID 63015916
2-(2-methylphenyl)-1-(1,4-oxathian-2-yl)ethanamine
CID 79963416
CID 67672299
CID 67672299
1-cyclobutyl-3-(2-methylphenyl)propan-1-amine
CID 105187525
1-(2-cyclopropylbutyl)-2-methylbenzene
CID 163903555
1-(1-ethoxy-4-methylcyclohexyl)-2-(2-methylphenyl)ethanamine
CID 116766935
1-(3,4-dihydro-2H-chromen-3-yl)-2-(2-methylphenyl)ethanamine
CID 65409504

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylphenyl)-1-(3-tricyclo[3.2.1.02,4]octanyl)ethanamine?
The IUPAC name of 2-(2-methylphenyl)-1-(3-tricyclo[3.2.1.02,4]octanyl)ethanamine (CID 114097065) is 2-(2-methylphenyl)-1-(3-tricyclo[3.2.1.02,4]octanyl)ethanamine.
What is the SMILES notation for 2-(2-methylphenyl)-1-(3-tricyclo[3.2.1.02,4]octanyl)ethanamine?
The canonical SMILES for 2-(2-methylphenyl)-1-(3-tricyclo[3.2.1.02,4]octanyl)ethanamine is Cc1ccccc1CC(N)C1C2C3CCC(C3)C12.
What is the InChIKey of 2-(2-methylphenyl)-1-(3-tricyclo[3.2.1.02,4]octanyl)ethanamine?
The InChIKey is KRSAEVLAVOLULU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N/c1-10-4-2-3-5-11(10)9-14(18)17-15-12-6-7-13(8-12)16(15)17/h2-5,12-17H,6-9,18H2,1H3.
What are the key properties of 2-(2-methylphenyl)-1-(3-tricyclo[3.2.1.02,4]octanyl)ethanamine?
2-(2-methylphenyl)-1-(3-tricyclo[3.2.1.02,4]octanyl)ethanamine has a molecular weight of 241.38 g/mol, XLogP of 3.16, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylphenyl)-1-(3-tricyclo[3.2.1.02,4]octanyl)ethanamine is sourced from PubChem (CID 114097065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).