(7-methoxy-1,4-dimethyl-2,3-dihydroindol-2-yl)methanamine

C12H18N2O — CID 83860766

IUPAC(7-methoxy-1,4-dimethyl-2,3-dihydroindol-2-yl)methanamine
SMILESCOc1ccc(C)c2c1N(C)C(CN)C2
InChIInChI=1S/C12H18N2O/c1-8-4-5-11(15-3)12-10(8)6-9(7-13)14(12)2/h4-5,9H,6-7,13H2,1-3H3
InChIKeyQGKBUXNEXNGWIZ-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.32
Rot. Bonds2

About (7-methoxy-1,4-dimethyl-2,3-dihydroindol-2-yl)methanamine

(7-methoxy-1,4-dimethyl-2,3-dihydroindol-2-yl)methanamine (PubChem CID 83860766) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is (7-methoxy-1,4-dimethyl-2,3-dihydroindol-2-yl)methanamine.

Molecular Properties

Compound Name(7-methoxy-1,4-dimethyl-2,3-dihydroindol-2-yl)methanamine
PubChem CID83860766
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name(7-methoxy-1,4-dimethyl-2,3-dihydroindol-2-yl)methanamine
SMILESCOc1ccc(C)c2c1N(C)C(CN)C2
InChIInChI=1S/C12H18N2O/c1-8-4-5-11(15-3)12-10(8)6-9(7-13)14(12)2/h4-5,9H,6-7,13H2,1-3H3
InChIKeyQGKBUXNEXNGWIZ-UHFFFAOYSA-N
XLogP1.32
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(7-methoxy-1-methyl-2,3-dihydroindol-2-yl)methanamine
CID 83860757
(8-methoxy-5-methyl-1,2,3,4-tetrahydroquinolin-2-yl)methanamine
CID 84620741
(1-ethyl-4-methoxy-2,3-dihydroindol-2-yl)methanamine
CID 117199162
(7-ethoxy-1-methyl-2,3-dihydroindol-2-yl)methanamine
CID 83860758
(8-methoxy-5,9-dimethyl-1,2,3,4-tetrahydrocarbazol-3-yl)methanamine
CID 84637426
(1,7,8-trimethyl-3,4-dihydro-2H-quinolin-2-yl)methanamine
CID 84620410
[3-(aminomethyl)morpholin-4-yl]-(4-methoxy-3-methylphenyl)methanone
CID 115270840
[5-(2,3-dimethoxy-6-methylphenyl)-1-methylpyrrolidin-3-yl]methanamine
CID 117415862
ethane;5-methoxy-8-methyl-1,2,3,4-tetrahydroisoquinoline
CID 145416816
3-ethyl-5-methoxy-4-methyl-2,3-dihydro-1H-quinoxaline
CID 84620814
8-methoxy-5,9-dimethyl-1,2,3,4-tetrahydropyrido[3,4-b]indole
CID 82495192
[1-[2-(3,4-dimethoxyphenyl)ethyl]aziridin-2-yl]methanamine
CID 117010060

Frequently Asked Questions

What is the IUPAC name of (7-methoxy-1,4-dimethyl-2,3-dihydroindol-2-yl)methanamine?
The IUPAC name of (7-methoxy-1,4-dimethyl-2,3-dihydroindol-2-yl)methanamine (CID 83860766) is (7-methoxy-1,4-dimethyl-2,3-dihydroindol-2-yl)methanamine.
What is the SMILES notation for (7-methoxy-1,4-dimethyl-2,3-dihydroindol-2-yl)methanamine?
The canonical SMILES for (7-methoxy-1,4-dimethyl-2,3-dihydroindol-2-yl)methanamine is COc1ccc(C)c2c1N(C)C(CN)C2.
What is the InChIKey of (7-methoxy-1,4-dimethyl-2,3-dihydroindol-2-yl)methanamine?
The InChIKey is QGKBUXNEXNGWIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-8-4-5-11(15-3)12-10(8)6-9(7-13)14(12)2/h4-5,9H,6-7,13H2,1-3H3.
What are the key properties of (7-methoxy-1,4-dimethyl-2,3-dihydroindol-2-yl)methanamine?
(7-methoxy-1,4-dimethyl-2,3-dihydroindol-2-yl)methanamine has a molecular weight of 206.29 g/mol, XLogP of 1.32, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (7-methoxy-1,4-dimethyl-2,3-dihydroindol-2-yl)methanamine is sourced from PubChem (CID 83860766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).