7-(aminomethyl)-8-methyl-5,6,7,8-tetrahydronaphthalen-2-ol

C12H17NO — CID 115057280

IUPAC7-(aminomethyl)-8-methyl-5,6,7,8-tetrahydronaphthalen-2-ol
SMILESCC1c2cc(O)ccc2CCC1CN
InChIInChI=1S/C12H17NO/c1-8-10(7-13)3-2-9-4-5-11(14)6-12(8)9/h4-6,8,10,14H,2-3,7,13H2,1H3
InChIKeyOTFQBXRWGBQPAB-UHFFFAOYSA-N
MW191.27 g/mol
LogP2.02
Rot. Bonds1

About 7-(aminomethyl)-8-methyl-5,6,7,8-tetrahydronaphthalen-2-ol

7-(aminomethyl)-8-methyl-5,6,7,8-tetrahydronaphthalen-2-ol (PubChem CID 115057280) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is 7-(aminomethyl)-8-methyl-5,6,7,8-tetrahydronaphthalen-2-ol.

Molecular Properties

Compound Name7-(aminomethyl)-8-methyl-5,6,7,8-tetrahydronaphthalen-2-ol
PubChem CID115057280
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC Name7-(aminomethyl)-8-methyl-5,6,7,8-tetrahydronaphthalen-2-ol
SMILESCC1c2cc(O)ccc2CCC1CN
InChIInChI=1S/C12H17NO/c1-8-10(7-13)3-2-9-4-5-11(14)6-12(8)9/h4-6,8,10,14H,2-3,7,13H2,1H3
InChIKeyOTFQBXRWGBQPAB-UHFFFAOYSA-N
XLogP2.02
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-methyl-1,2,3,4-tetrahydronaphthalene-2,7-diol
CID 115010784
7-hydroxy-1-methyl-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid
CID 115057019
3-(2-aminoethyl)-2,3-dihydro-1H-inden-5-ol
CID 83827747
6-[(4-hydroxy-2-methylphenyl)methyl]-5-methyl-5,6,7,8-tetrahydronaphthalen-2-ol
CID 142144692
6-[(5-hydroxy-2-methylphenyl)methyl]-5-methyl-5,6,7,8-tetrahydronaphthalen-2-ol
CID 142144702
7-amino-8-bromo-5,6,7,8-tetrahydronaphthalen-2-ol
CID 139779177
(8R)-8-amino-7-benzyl-5,6,7,8-tetrahydronaphthalen-2-ol
CID 70366570
(8S)-8-amino-7-benzyl-5,6,7,8-tetrahydronaphthalen-2-ol
CID 70366538
(7S)-7-(aminomethyl)-5,6,7,8-tetrahydronaphthalen-2-ol
CID 15718602
(1-tert-butyl-7-methyl-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
CID 115057920
4-(aminomethyl)-2,3,4,4a,5,6-hexahydro-1H-benzo[c]quinolizin-9-ol
CID 105491505
4-[2-[(7-hydroxy-1-methyl-1,2,3,4-tetrahydronaphthalen-2-yl)amino]ethyl]benzenesulfonamide
CID 144623345

Frequently Asked Questions

What is the IUPAC name of 7-(aminomethyl)-8-methyl-5,6,7,8-tetrahydronaphthalen-2-ol?
The IUPAC name of 7-(aminomethyl)-8-methyl-5,6,7,8-tetrahydronaphthalen-2-ol (CID 115057280) is 7-(aminomethyl)-8-methyl-5,6,7,8-tetrahydronaphthalen-2-ol.
What is the SMILES notation for 7-(aminomethyl)-8-methyl-5,6,7,8-tetrahydronaphthalen-2-ol?
The canonical SMILES for 7-(aminomethyl)-8-methyl-5,6,7,8-tetrahydronaphthalen-2-ol is CC1c2cc(O)ccc2CCC1CN.
What is the InChIKey of 7-(aminomethyl)-8-methyl-5,6,7,8-tetrahydronaphthalen-2-ol?
The InChIKey is OTFQBXRWGBQPAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO/c1-8-10(7-13)3-2-9-4-5-11(14)6-12(8)9/h4-6,8,10,14H,2-3,7,13H2,1H3.
What are the key properties of 7-(aminomethyl)-8-methyl-5,6,7,8-tetrahydronaphthalen-2-ol?
7-(aminomethyl)-8-methyl-5,6,7,8-tetrahydronaphthalen-2-ol has a molecular weight of 191.27 g/mol, XLogP of 2.02, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(aminomethyl)-8-methyl-5,6,7,8-tetrahydronaphthalen-2-ol is sourced from PubChem (CID 115057280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).