actinium;[(5R)-5,6,7,8-tetrahydroisoquinolin-5-yl]azanide

C9H11AcN2- — CID 59074393

IUPACactinium;[(5R)-5,6,7,8-tetrahydroisoquinolin-5-yl]azanide
SMILES[Ac].[NH-][C@@H]1CCCc2cnccc21
InChIInChI=1S/C9H11N2.Ac/c10-9-3-1-2-7-6-11-5-4-8(7)9;/h4-6,9-10H,1-3H2;/q-1;/t9-;/m1./s1
InChIKeyOQBNQWMIHUBTSN-SBSPUUFOSA-N
MW374.20 g/mol
LogP2.51
Rot. Bonds

About actinium;[(5R)-5,6,7,8-tetrahydroisoquinolin-5-yl]azanide

actinium;[(5R)-5,6,7,8-tetrahydroisoquinolin-5-yl]azanide (PubChem CID 59074393) has the molecular formula C9H11AcN2- and a molecular weight of 374.20 g/mol. Its IUPAC name is actinium;[(5R)-5,6,7,8-tetrahydroisoquinolin-5-yl]azanide.

Molecular Properties

Compound Nameactinium;[(5R)-5,6,7,8-tetrahydroisoquinolin-5-yl]azanide
PubChem CID59074393
Molecular FormulaC9H11AcN2-
Molecular Weight374.20 g/mol
Exact Mass374.12
IUPAC Nameactinium;[(5R)-5,6,7,8-tetrahydroisoquinolin-5-yl]azanide
SMILES[Ac].[NH-][C@@H]1CCCc2cnccc21
InChIInChI=1S/C9H11N2.Ac/c10-9-3-1-2-7-6-11-5-4-8(7)9;/h4-6,9-10H,1-3H2;/q-1;/t9-;/m1./s1
InChIKeyOQBNQWMIHUBTSN-SBSPUUFOSA-N
XLogP2.51
TPSA36.69 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.20
LogP ≤ 52.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(5S)-5-chloro-5,6,7,8-tetrahydroisoquinoline
CID 124706971
6,7-dihydro-5H-cyclopenta[c]pyridin-5-ol
CID 12042863
(5R)-6,7-dihydro-5H-cyclopenta[c]pyridin-5-ol
CID 92845053
5-ethyl-5,6,7,8,9,10,11,12,13,14-decahydrocyclododeca[c]pyridine
CID 143716647
ethane;(5S)-5-methyl-6,7-dihydro-5H-cyclopenta[c]pyridine
CID 170960546
5-(2-methylsulfanylpropyl)-5,6,7,8-tetrahydroisoquinoline
CID 146618111
1-(5,6,7,8-tetrahydroisoquinolin-5-yl)piperidine-4-carboxamide
CID 172702565
[1-(5,6,7,8-tetrahydroisoquinolin-5-yl)pyrazol-4-yl]boronic acid
CID 155713956
(8S)-N,N-dimethyl-5,6,7,8-tetrahydroisoquinolin-8-amine
CID 92846477
N-cyclopropyl-5,6,7,8-tetrahydroisoquinolin-8-amine
CID 83907169
6,6-dimethyl-7,8-dihydro-5H-isoquinolin-5-amine
CID 112714469
7-iodo-3-azabicyclo[4.2.0]octa-1(6),2,4-triene
CID 11966049

Frequently Asked Questions

What is the IUPAC name of actinium;[(5R)-5,6,7,8-tetrahydroisoquinolin-5-yl]azanide?
The IUPAC name of actinium;[(5R)-5,6,7,8-tetrahydroisoquinolin-5-yl]azanide (CID 59074393) is actinium;[(5R)-5,6,7,8-tetrahydroisoquinolin-5-yl]azanide.
What is the SMILES notation for actinium;[(5R)-5,6,7,8-tetrahydroisoquinolin-5-yl]azanide?
The canonical SMILES for actinium;[(5R)-5,6,7,8-tetrahydroisoquinolin-5-yl]azanide is [Ac].[NH-][C@@H]1CCCc2cnccc21.
What is the InChIKey of actinium;[(5R)-5,6,7,8-tetrahydroisoquinolin-5-yl]azanide?
The InChIKey is OQBNQWMIHUBTSN-SBSPUUFOSA-N. The full InChI is InChI=1S/C9H11N2.Ac/c10-9-3-1-2-7-6-11-5-4-8(7)9;/h4-6,9-10H,1-3H2;/q-1;/t9-;/m1./s1.
What are the key properties of actinium;[(5R)-5,6,7,8-tetrahydroisoquinolin-5-yl]azanide?
actinium;[(5R)-5,6,7,8-tetrahydroisoquinolin-5-yl]azanide has a molecular weight of 374.20 g/mol, XLogP of 2.51, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for actinium;[(5R)-5,6,7,8-tetrahydroisoquinolin-5-yl]azanide is sourced from PubChem (CID 59074393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).