(8-methoxy-5,9-dimethyl-1,2,3,4-tetrahydrocarbazol-3-yl)methanamine

C16H22N2O — CID 84637426

IUPAC(8-methoxy-5,9-dimethyl-1,2,3,4-tetrahydrocarbazol-3-yl)methanamine
SMILESCOc1ccc(C)c2c3c(n(C)c12)CCC(CN)C3
InChIInChI=1S/C16H22N2O/c1-10-4-7-14(19-3)16-15(10)12-8-11(9-17)5-6-13(12)18(16)2/h4,7,11H,5-6,8-9,17H2,1-3H3
InChIKeyVUCFRULPQZKOGT-UHFFFAOYSA-N
MW258.36 g/mol
LogP2.56
Rot. Bonds2

About (8-methoxy-5,9-dimethyl-1,2,3,4-tetrahydrocarbazol-3-yl)methanamine

(8-methoxy-5,9-dimethyl-1,2,3,4-tetrahydrocarbazol-3-yl)methanamine (PubChem CID 84637426) has the molecular formula C16H22N2O and a molecular weight of 258.36 g/mol. Its IUPAC name is (8-methoxy-5,9-dimethyl-1,2,3,4-tetrahydrocarbazol-3-yl)methanamine.

Molecular Properties

Compound Name(8-methoxy-5,9-dimethyl-1,2,3,4-tetrahydrocarbazol-3-yl)methanamine
PubChem CID84637426
Molecular FormulaC16H22N2O
Molecular Weight258.36 g/mol
Exact Mass258.17
IUPAC Name(8-methoxy-5,9-dimethyl-1,2,3,4-tetrahydrocarbazol-3-yl)methanamine
SMILESCOc1ccc(C)c2c3c(n(C)c12)CCC(CN)C3
InChIInChI=1S/C16H22N2O/c1-10-4-7-14(19-3)16-15(10)12-8-11(9-17)5-6-13(12)18(16)2/h4,7,11H,5-6,8-9,17H2,1-3H3
InChIKeyVUCFRULPQZKOGT-UHFFFAOYSA-N
XLogP2.56
TPSA40.18 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

8-methoxy-5,9-dimethyl-1,2,3,4-tetrahydrocarbazol-2-amine
CID 83488134
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-4-yl)methanamine
CID 84742511
2-(8-methoxy-5-methyl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanamine
CID 82500174
(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine;hydrochloride
CID 19888691
5,8,9-trimethyl-1,2,3,4-tetrahydropyrido[3,4-b]indole
CID 82492831
5-chloro-8-methoxy-9-methyl-1,2,3,4-tetrahydrocarbazol-4-amine
CID 84742810
(7-methoxy-1,4-dimethyl-2,3-dihydroindol-2-yl)methanamine
CID 83860766
(4-methoxy-6,7,8,9-tetrahydropyrido[1,2-a]indol-8-yl)methanamine
CID 105488431
(8-methoxy-5-methyl-1,2,3,4-tetrahydroquinolin-2-yl)methanamine
CID 84620741
1-(7-methoxy-1,4-dimethyl-3-propan-2-ylindol-2-yl)-N-methylmethanamine
CID 84638336
[5-(2,3-dimethoxy-6-methylphenyl)-1-methylpyrrolidin-3-yl]methanamine
CID 117415862

Frequently Asked Questions

What is the IUPAC name of (8-methoxy-5,9-dimethyl-1,2,3,4-tetrahydrocarbazol-3-yl)methanamine?
The IUPAC name of (8-methoxy-5,9-dimethyl-1,2,3,4-tetrahydrocarbazol-3-yl)methanamine (CID 84637426) is (8-methoxy-5,9-dimethyl-1,2,3,4-tetrahydrocarbazol-3-yl)methanamine.
What is the SMILES notation for (8-methoxy-5,9-dimethyl-1,2,3,4-tetrahydrocarbazol-3-yl)methanamine?
The canonical SMILES for (8-methoxy-5,9-dimethyl-1,2,3,4-tetrahydrocarbazol-3-yl)methanamine is COc1ccc(C)c2c3c(n(C)c12)CCC(CN)C3.
What is the InChIKey of (8-methoxy-5,9-dimethyl-1,2,3,4-tetrahydrocarbazol-3-yl)methanamine?
The InChIKey is VUCFRULPQZKOGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O/c1-10-4-7-14(19-3)16-15(10)12-8-11(9-17)5-6-13(12)18(16)2/h4,7,11H,5-6,8-9,17H2,1-3H3.
What are the key properties of (8-methoxy-5,9-dimethyl-1,2,3,4-tetrahydrocarbazol-3-yl)methanamine?
(8-methoxy-5,9-dimethyl-1,2,3,4-tetrahydrocarbazol-3-yl)methanamine has a molecular weight of 258.36 g/mol, XLogP of 2.56, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (8-methoxy-5,9-dimethyl-1,2,3,4-tetrahydrocarbazol-3-yl)methanamine is sourced from PubChem (CID 84637426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).