2-(2-aminoethyl)-5,6,7,8-tetrahydronaphthalen-1-ol

C12H17NO — CID 117282549

IUPAC2-(2-aminoethyl)-5,6,7,8-tetrahydronaphthalen-1-ol
SMILESNCCc1ccc2c(c1O)CCCC2
InChIInChI=1S/C12H17NO/c13-8-7-10-6-5-9-3-1-2-4-11(9)12(10)14/h5-6,14H,1-4,7-8,13H2
InChIKeyMZJBDIMIKPAIMR-UHFFFAOYSA-N
MW191.27 g/mol
LogP1.77
Rot. Bonds2

About 2-(2-aminoethyl)-5,6,7,8-tetrahydronaphthalen-1-ol

2-(2-aminoethyl)-5,6,7,8-tetrahydronaphthalen-1-ol (PubChem CID 117282549) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is 2-(2-aminoethyl)-5,6,7,8-tetrahydronaphthalen-1-ol.

Molecular Properties

Compound Name2-(2-aminoethyl)-5,6,7,8-tetrahydronaphthalen-1-ol
PubChem CID117282549
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC Name2-(2-aminoethyl)-5,6,7,8-tetrahydronaphthalen-1-ol
SMILESNCCc1ccc2c(c1O)CCCC2
InChIInChI=1S/C12H17NO/c13-8-7-10-6-5-9-3-1-2-4-11(9)12(10)14/h5-6,14H,1-4,7-8,13H2
InChIKeyMZJBDIMIKPAIMR-UHFFFAOYSA-N
XLogP1.77
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-aminopropyl)-5,6,7,8-tetrahydronaphthalen-1-ol
CID 117294086
2-(4-methoxy-2,3-dihydro-1H-inden-5-yl)ethanamine
CID 117282550
2-(4-hydroxy-2,3-dihydro-1H-inden-5-yl)acetonitrile
CID 117277009
5-(2-piperazin-1-ylethyl)-2,3-dihydro-1H-inden-4-ol
CID 117368753
3-(1-hydroxy-5,6,7,8-tetrahydronaphthalen-2-yl)-2-methylpropanoic acid
CID 117340695
2-(2,3-dihydro-1H-inden-5-yl)ethanamine
CID 61070182
5-iodo-2,3-dihydro-1H-inden-4-ol
CID 23031206
2-bromo-5,6,7,8-tetrahydronaphthalen-1-ol
CID 22252946
2-(2,3-dihydro-1H-inden-5-yl)ethanamine;hydrochloride
CID 135381745
2-[5-(aminomethyl)-1,2,4-oxadiazol-3-yl]-5,6,7,8-tetrahydronaphthalen-1-ol
CID 137011517
2-[3-aminopropyl(propyl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol
CID 169095475
1-hydroxy-5,6,7,8-tetrahydronaphthalene-2-carbonitrile
CID 117277012

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminoethyl)-5,6,7,8-tetrahydronaphthalen-1-ol?
The IUPAC name of 2-(2-aminoethyl)-5,6,7,8-tetrahydronaphthalen-1-ol (CID 117282549) is 2-(2-aminoethyl)-5,6,7,8-tetrahydronaphthalen-1-ol.
What is the SMILES notation for 2-(2-aminoethyl)-5,6,7,8-tetrahydronaphthalen-1-ol?
The canonical SMILES for 2-(2-aminoethyl)-5,6,7,8-tetrahydronaphthalen-1-ol is NCCc1ccc2c(c1O)CCCC2.
What is the InChIKey of 2-(2-aminoethyl)-5,6,7,8-tetrahydronaphthalen-1-ol?
The InChIKey is MZJBDIMIKPAIMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO/c13-8-7-10-6-5-9-3-1-2-4-11(9)12(10)14/h5-6,14H,1-4,7-8,13H2.
What are the key properties of 2-(2-aminoethyl)-5,6,7,8-tetrahydronaphthalen-1-ol?
2-(2-aminoethyl)-5,6,7,8-tetrahydronaphthalen-1-ol has a molecular weight of 191.27 g/mol, XLogP of 1.77, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminoethyl)-5,6,7,8-tetrahydronaphthalen-1-ol is sourced from PubChem (CID 117282549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).