(5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanamine

C13H19NO — CID 84620615

IUPAC(5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
SMILESCOc1cccc2c1CC(C)CC2CN
InChIInChI=1S/C13H19NO/c1-9-6-10(8-14)11-4-3-5-13(15-2)12(11)7-9/h3-5,9-10H,6-8,14H2,1-2H3
InChIKeyYZWAPOOLVPOYOM-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.32
Rot. Bonds2

About (5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanamine

(5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanamine (PubChem CID 84620615) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is (5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanamine.

Molecular Properties

Compound Name(5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
PubChem CID84620615
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name(5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
SMILESCOc1cccc2c1CC(C)CC2CN
InChIInChI=1S/C13H19NO/c1-9-6-10(8-14)11-4-3-5-13(15-2)12(11)7-9/h3-5,9-10H,6-8,14H2,1-2H3
InChIKeyYZWAPOOLVPOYOM-UHFFFAOYSA-N
XLogP2.32
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 63820817
(5-bromo-3-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
CID 84635120
5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
CID 63822286
N-ethyl-5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 63822452
(6-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
CID 84620620
4-methoxy-2-methyl-2,3-dihydro-1H-inden-1-ol
CID 79726670
6-methoxy-4-methyl-1-(2-methylpropyl)-2,3,4,5-tetrahydro-1H-2-benzazepine
CID 64687610
(2S)-8-methoxy-2-methyl-1,2,3,4-tetrahydronaphthalene
CID 67639312
(1-ethyl-4-methoxy-2,3-dihydroindol-2-yl)methanamine
CID 117199162
6-methoxy-2,2a,7,7a-tetrahydro-1H-cyclobuta[a]indene
CID 90201598
[(1S,2S)-2-(2,3-dimethoxyphenyl)cyclopropyl]methanamine
CID 94557662
[(1R,2R)-2-(2,3-dimethoxyphenyl)cyclopropyl]methanamine
CID 94557663

Frequently Asked Questions

What is the IUPAC name of (5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanamine?
The IUPAC name of (5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanamine (CID 84620615) is (5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanamine.
What is the SMILES notation for (5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanamine?
The canonical SMILES for (5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanamine is COc1cccc2c1CC(C)CC2CN.
What is the InChIKey of (5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanamine?
The InChIKey is YZWAPOOLVPOYOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-9-6-10(8-14)11-4-3-5-13(15-2)12(11)7-9/h3-5,9-10H,6-8,14H2,1-2H3.
What are the key properties of (5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanamine?
(5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanamine has a molecular weight of 205.30 g/mol, XLogP of 2.32, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanamine is sourced from PubChem (CID 84620615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).