2-(8-methoxy-5-methyl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanamine

C16H22N2O — CID 82500174

IUPAC2-(8-methoxy-5-methyl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanamine
SMILESCOc1ccc(C)c2c3c(n(CCN)c12)CCCC3
InChIInChI=1S/C16H22N2O/c1-11-7-8-14(19-2)16-15(11)12-5-3-4-6-13(12)18(16)10-9-17/h7-8H,3-6,9-10,17H2,1-2H3
InChIKeyNXFDIYQWZQSYHK-UHFFFAOYSA-N
MW258.36 g/mol
LogP2.80
Rot. Bonds3

About 2-(8-methoxy-5-methyl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanamine

2-(8-methoxy-5-methyl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanamine (PubChem CID 82500174) has the molecular formula C16H22N2O and a molecular weight of 258.36 g/mol. Its IUPAC name is 2-(8-methoxy-5-methyl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanamine.

Molecular Properties

Compound Name2-(8-methoxy-5-methyl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanamine
PubChem CID82500174
Molecular FormulaC16H22N2O
Molecular Weight258.36 g/mol
Exact Mass258.17
IUPAC Name2-(8-methoxy-5-methyl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanamine
SMILESCOc1ccc(C)c2c3c(n(CCN)c12)CCCC3
InChIInChI=1S/C16H22N2O/c1-11-7-8-14(19-2)16-15(11)12-5-3-4-6-13(12)18(16)10-9-17/h7-8H,3-6,9-10,17H2,1-2H3
InChIKeyNXFDIYQWZQSYHK-UHFFFAOYSA-N
XLogP2.80
TPSA40.18 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(5,7-dimethoxy-1,2,3,4-tetrahydrocarbazol-9-yl)ethanamine
CID 96680178
8-methoxy-5,9-dimethyl-1,2,3,4-tetrahydropyrido[3,4-b]indole
CID 82495192
8-methoxy-5,9-dimethyl-1,2,3,4-tetrahydrocarbazol-2-amine
CID 83488134
(8-methoxy-5,9-dimethyl-1,2,3,4-tetrahydrocarbazol-3-yl)methanamine
CID 84637426
(8-methoxy-5,9-dimethyl-1,2,3,4-tetrahydrocarbazol-4-yl)methanamine
CID 84742511
2-(4-methoxy-2,7-dimethylindol-1-yl)ethanamine
CID 135333368
3-(7-methoxy-1,4-dimethylindol-3-yl)propan-1-amine
CID 82495903
2-(4-fluoro-7-methoxy-2-methylindol-1-yl)ethanamine
CID 135333176
3-amino-1-(4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl)propan-1-one
CID 117338427
9-(2-aminoethyl)-N-(3-chloro-4-methylphenyl)-5,6,7,8-tetrahydrocarbazol-3-amine;ethane
CID 171793515
5,8,9-trimethyl-1,2,3,4-tetrahydropyrido[3,4-b]indole
CID 82492831
1-(7-methoxy-1,4-dimethylindol-3-yl)propan-2-one
CID 82495456

Frequently Asked Questions

What is the IUPAC name of 2-(8-methoxy-5-methyl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanamine?
The IUPAC name of 2-(8-methoxy-5-methyl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanamine (CID 82500174) is 2-(8-methoxy-5-methyl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanamine.
What is the SMILES notation for 2-(8-methoxy-5-methyl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanamine?
The canonical SMILES for 2-(8-methoxy-5-methyl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanamine is COc1ccc(C)c2c3c(n(CCN)c12)CCCC3.
What is the InChIKey of 2-(8-methoxy-5-methyl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanamine?
The InChIKey is NXFDIYQWZQSYHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O/c1-11-7-8-14(19-2)16-15(11)12-5-3-4-6-13(12)18(16)10-9-17/h7-8H,3-6,9-10,17H2,1-2H3.
What are the key properties of 2-(8-methoxy-5-methyl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanamine?
2-(8-methoxy-5-methyl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanamine has a molecular weight of 258.36 g/mol, XLogP of 2.80, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(8-methoxy-5-methyl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanamine is sourced from PubChem (CID 82500174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).