2-[ethyl(methyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol

C14H21NO — CID 115419992

IUPAC2-[ethyl(methyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
SMILESCCN(C)C1CC(C)c2ccccc2C1O
InChIInChI=1S/C14H21NO/c1-4-15(3)13-9-10(2)11-7-5-6-8-12(11)14(13)16/h5-8,10,13-14,16H,4,9H2,1-3H3
InChIKeyAGQCSRJQTVVIPO-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.55
Rot. Bonds2

About 2-[ethyl(methyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol

2-[ethyl(methyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol (PubChem CID 115419992) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 2-[ethyl(methyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol.

Molecular Properties

Compound Name2-[ethyl(methyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
PubChem CID115419992
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name2-[ethyl(methyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
SMILESCCN(C)C1CC(C)c2ccccc2C1O
InChIInChI=1S/C14H21NO/c1-4-15(3)13-9-10(2)11-7-5-6-8-12(11)14(13)16/h5-8,10,13-14,16H,4,9H2,1-3H3
InChIKeyAGQCSRJQTVVIPO-UHFFFAOYSA-N
XLogP2.55
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-methyl-2-[methyl(pyridin-4-ylmethyl)amino]-1,2,3,4-tetrahydronaphthalen-1-ol
CID 115420013
2-[cyclopropyl(propyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
CID 115419999
2-[ethyl(oxolan-2-ylmethyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
CID 115420032
4-methyl-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]-1,2,3,4-tetrahydronaphthalen-1-ol
CID 115420047
4-methyl-2-[methyl-(1-methylpiperidin-4-yl)amino]-1,2,3,4-tetrahydronaphthalen-1-ol
CID 115419981
2-[butan-2-yl(2-methoxyethyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
CID 115420046
4-methyl-2-propoxy-1,2,3,4-tetrahydronaphthalen-1-ol
CID 115420176
(1R,3S)-3-methyl-2,3-dihydro-1H-inden-1-ol
CID 640582
(3S)-1,3-dimethyl-2,3-dihydro-1H-indene
CID 143951833
(1R,3R)-2-methyl-2,3-dihydro-1H-indene-1,3-diol
CID 10535021
2-N-butyl-1-N-ethyl-2-N,4-dimethyl-1,2,3,4-tetrahydronaphthalene-1,2-diamine
CID 115418822
2-N-(2-methoxyethyl)-2-N,4-dimethyl-1,2,3,4-tetrahydronaphthalene-1,2-diamine
CID 115418942

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl(methyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol?
The IUPAC name of 2-[ethyl(methyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol (CID 115419992) is 2-[ethyl(methyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol.
What is the SMILES notation for 2-[ethyl(methyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol?
The canonical SMILES for 2-[ethyl(methyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol is CCN(C)C1CC(C)c2ccccc2C1O.
What is the InChIKey of 2-[ethyl(methyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol?
The InChIKey is AGQCSRJQTVVIPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-4-15(3)13-9-10(2)11-7-5-6-8-12(11)14(13)16/h5-8,10,13-14,16H,4,9H2,1-3H3.
What are the key properties of 2-[ethyl(methyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol?
2-[ethyl(methyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol has a molecular weight of 219.33 g/mol, XLogP of 2.55, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl(methyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol is sourced from PubChem (CID 115419992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).