6-amino-5,6,7,8-tetrahydronaphthalen-2-ol;N-benzyl-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;7-chloro-5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidine;6-[[5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]amino]-5,6,7,8-tetrahydronaphthalen-2-ol;(6R)-6-[[5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]amino]-5,6,7,8-tetrahydronaphthalen-2-ol;methane;6-methoxy-3,4-dihydro-1H-naphthalen-2-one;6-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;phenylmethanamine

C124H150ClF3N18O7 — CID 159409778

IUPAC6-amino-5,6,7,8-tetrahydronaphthalen-2-ol;N-benzyl-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;7-chloro-5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidine;6-[[5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]amino]-5,6,7,8-tetrahydronaphthalen-2-ol;(6R)-6-[[5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]amino]-5,6,7,8-tetrahydronaphthalen-2-ol;methane;6-methoxy-3,4-dihydro-1H-naphthalen-2-one;6-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;phenylmethanamine
SMILESC.C.C.C.C.CC(C)c1cnn2c(Cl)cc(-c3cncc(F)c3)nc12.CC(C)c1cnn2c(NC3CCc4cc(O)ccc4C3)cc(-c3cncc(F)c3)nc12.CC(C)c1cnn2c(N[C@@H]3CCc4cc(O)ccc4C3)cc(-c3cncc(F)c3)nc12.COc1ccc2c(c1)CCC(=O)C2.COc1ccc2c(c1)CCC(N)C2.COc1ccc2c(c1)CCC(NCc1ccccc1)C2.NC1CCc2cc(O)ccc2C1.NCc1ccccc1
InChIInChI=1S/2C24H24FN5O.C18H21NO.C14H12ClFN4.C11H15NO.C11H12O2.C10H13NO.C7H9N.5CH4/c2*1-14(2)21-13-27-30-23(10-22(29-24(21)30)17-7-18(25)12-26-11-17)28-19-5-3-16-9-20(31)6-4-15(16)8-19;1-20-18-10-8-15-11-17(9-7-16(15)12-18)19-13-14-5-3-2-4-6-14;1-8(2)11-7-18-20-13(15)4-12(19-14(11)20)9-3-10(16)6-17-5-9;2*1-13-11-5-3-8-6-10(12)4-2-9(8)7-11;11-9-3-1-8-6-10(12)4-2-7(8)5-9;8-6-7-4-2-1-3-5-7;;;;;/h2*4,6-7,9-14,19,28,31H,3,5,8H2,1-2H3;2-6,8,10,12,17,19H,7,9,11,13H2,1H3;3-8H,1-2H3;3,5,7,10H,2,4,6,12H2,1H3;3,5,7H,2,4,6H2,1H3;2,4,6,9,12H,1,3,5,11H2;1-5H,6,8H2;5*1H4/t19-;;;;;;;;;;;;/m1............/s1
InChIKeyLOKWUQFXQJOMBR-LGFKXHNUSA-N
MW2097.13 g/mol
LogP25.31
Rot. Bonds17

About 6-amino-5,6,7,8-tetrahydronaphthalen-2-ol;N-benzyl-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;7-chloro-5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidine;6-[[5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]amino]-5,6,7,8-tetrahydronaphthalen-2-ol;(6R)-6-[[5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]amino]-5,6,7,8-tetrahydronaphthalen-2-ol;methane;6-methoxy-3,4-dihydro-1H-naphthalen-2-one;6-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;phenylmethanamine

6-amino-5,6,7,8-tetrahydronaphthalen-2-ol;N-benzyl-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;7-chloro-5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidine;6-[[5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]amino]-5,6,7,8-tetrahydronaphthalen-2-ol;(6R)-6-[[5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]amino]-5,6,7,8-tetrahydronaphthalen-2-ol;methane;6-methoxy-3,4-dihydro-1H-naphthalen-2-one;6-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;phenylmethanamine (PubChem CID 159409778) has the molecular formula C124H150ClF3N18O7 and a molecular weight of 2097.13 g/mol. Its IUPAC name is 6-amino-5,6,7,8-tetrahydronaphthalen-2-ol;N-benzyl-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;7-chloro-5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidine;6-[[5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]amino]-5,6,7,8-tetrahydronaphthalen-2-ol;(6R)-6-[[5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]amino]-5,6,7,8-tetrahydronaphthalen-2-ol;methane;6-methoxy-3,4-dihydro-1H-naphthalen-2-one;6-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;phenylmethanamine.

Molecular Properties

Compound Name6-amino-5,6,7,8-tetrahydronaphthalen-2-ol;N-benzyl-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;7-chloro-5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidine;6-[[5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]amino]-5,6,7,8-tetrahydronaphthalen-2-ol;(6R)-6-[[5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]amino]-5,6,7,8-tetrahydronaphthalen-2-ol;methane;6-methoxy-3,4-dihydro-1H-naphthalen-2-one;6-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;phenylmethanamine
PubChem CID159409778
Molecular FormulaC124H150ClF3N18O7
Molecular Weight2097.13 g/mol
Exact Mass2095.16
IUPAC Name6-amino-5,6,7,8-tetrahydronaphthalen-2-ol;N-benzyl-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;7-chloro-5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidine;6-[[5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]amino]-5,6,7,8-tetrahydronaphthalen-2-ol;(6R)-6-[[5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]amino]-5,6,7,8-tetrahydronaphthalen-2-ol;methane;6-methoxy-3,4-dihydro-1H-naphthalen-2-one;6-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;phenylmethanamine
SMILESC.C.C.C.C.CC(C)c1cnn2c(Cl)cc(-c3cncc(F)c3)nc12.CC(C)c1cnn2c(NC3CCc4cc(O)ccc4C3)cc(-c3cncc(F)c3)nc12.CC(C)c1cnn2c(N[C@@H]3CCc4cc(O)ccc4C3)cc(-c3cncc(F)c3)nc12.COc1ccc2c(c1)CCC(=O)C2.COc1ccc2c(c1)CCC(N)C2.COc1ccc2c(c1)CCC(NCc1ccccc1)C2.NC1CCc2cc(O)ccc2C1.NCc1ccccc1
InChIInChI=1S/2C24H24FN5O.C18H21NO.C14H12ClFN4.C11H15NO.C11H12O2.C10H13NO.C7H9N.5CH4/c2*1-14(2)21-13-27-30-23(10-22(29-24(21)30)17-7-18(25)12-26-11-17)28-19-5-3-16-9-20(31)6-4-15(16)8-19;1-20-18-10-8-15-11-17(9-7-16(15)12-18)19-13-14-5-3-2-4-6-14;1-8(2)11-7-18-20-13(15)4-12(19-14(11)20)9-3-10(16)6-17-5-9;2*1-13-11-5-3-8-6-10(12)4-2-9(8)7-11;11-9-3-1-8-6-10(12)4-2-7(8)5-9;8-6-7-4-2-1-3-5-7;;;;;/h2*4,6-7,9-14,19,28,31H,3,5,8H2,1-2H3;2-6,8,10,12,17,19H,7,9,11,13H2,1H3;3-8H,1-2H3;3,5,7,10H,2,4,6,12H2,1H3;3,5,7H,2,4,6H2,1H3;2,4,6,9,12H,1,3,5,11H2;1-5H,6,8H2;5*1H4/t19-;;;;;;;;;;;;/m1............/s1
InChIKeyLOKWUQFXQJOMBR-LGFKXHNUSA-N
XLogP25.31
TPSA348.84 Ų
H-Bond Donors9
H-Bond Acceptors25
Rotatable Bonds17
Heavy Atoms153
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002097.13
LogP ≤ 525.31
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1025

Analyze 6-amino-5,6,7,8-tetrahydronaphthalen-2-ol;N-benzyl-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;7-chloro-5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidine;6-[[5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]amino]-5,6,7,8-tetrahydronaphthalen-2-ol;(6R)-6-[[5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]amino]-5,6,7,8-tetrahydronaphthalen-2-ol;methane;6-methoxy-3,4-dihydro-1H-naphthalen-2-one;6-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;phenylmethanamine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-amino-5,6,7,8-tetrahydronaphthalen-2-ol;N-benzyl-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;7-chloro-5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidine;6-[[5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]amino]-5,6,7,8-tetrahydronaphthalen-2-ol;(6R)-6-[[5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]amino]-5,6,7,8-tetrahydronaphthalen-2-ol;methane;6-methoxy-3,4-dihydro-1H-naphthalen-2-one;6-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;phenylmethanamine?
The IUPAC name of 6-amino-5,6,7,8-tetrahydronaphthalen-2-ol;N-benzyl-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;7-chloro-5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidine;6-[[5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]amino]-5,6,7,8-tetrahydronaphthalen-2-ol;(6R)-6-[[5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]amino]-5,6,7,8-tetrahydronaphthalen-2-ol;methane;6-methoxy-3,4-dihydro-1H-naphthalen-2-one;6-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;phenylmethanamine (CID 159409778) is 6-amino-5,6,7,8-tetrahydronaphthalen-2-ol;N-benzyl-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;7-chloro-5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidine;6-[[5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]amino]-5,6,7,8-tetrahydronaphthalen-2-ol;(6R)-6-[[5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]amino]-5,6,7,8-tetrahydronaphthalen-2-ol;methane;6-methoxy-3,4-dihydro-1H-naphthalen-2-one;6-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;phenylmethanamine.
What is the SMILES notation for 6-amino-5,6,7,8-tetrahydronaphthalen-2-ol;N-benzyl-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;7-chloro-5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidine;6-[[5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]amino]-5,6,7,8-tetrahydronaphthalen-2-ol;(6R)-6-[[5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]amino]-5,6,7,8-tetrahydronaphthalen-2-ol;methane;6-methoxy-3,4-dihydro-1H-naphthalen-2-one;6-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;phenylmethanamine?
The canonical SMILES for 6-amino-5,6,7,8-tetrahydronaphthalen-2-ol;N-benzyl-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;7-chloro-5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidine;6-[[5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]amino]-5,6,7,8-tetrahydronaphthalen-2-ol;(6R)-6-[[5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]amino]-5,6,7,8-tetrahydronaphthalen-2-ol;methane;6-methoxy-3,4-dihydro-1H-naphthalen-2-one;6-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;phenylmethanamine is C.C.C.C.C.CC(C)c1cnn2c(Cl)cc(-c3cncc(F)c3)nc12.CC(C)c1cnn2c(NC3CCc4cc(O)ccc4C3)cc(-c3cncc(F)c3)nc12.CC(C)c1cnn2c(N[C@@H]3CCc4cc(O)ccc4C3)cc(-c3cncc(F)c3)nc12.COc1ccc2c(c1)CCC(=O)C2.COc1ccc2c(c1)CCC(N)C2.COc1ccc2c(c1)CCC(NCc1ccccc1)C2.NC1CCc2cc(O)ccc2C1.NCc1ccccc1.
What is the InChIKey of 6-amino-5,6,7,8-tetrahydronaphthalen-2-ol;N-benzyl-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;7-chloro-5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidine;6-[[5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]amino]-5,6,7,8-tetrahydronaphthalen-2-ol;(6R)-6-[[5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]amino]-5,6,7,8-tetrahydronaphthalen-2-ol;methane;6-methoxy-3,4-dihydro-1H-naphthalen-2-one;6-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;phenylmethanamine?
The InChIKey is LOKWUQFXQJOMBR-LGFKXHNUSA-N. The full InChI is InChI=1S/2C24H24FN5O.C18H21NO.C14H12ClFN4.C11H15NO.C11H12O2.C10H13NO.C7H9N.5CH4/c2*1-14(2)21-13-27-30-23(10-22(29-24(21)30)17-7-18(25)12-26-11-17)28-19-5-3-16-9-20(31)6-4-15(16)8-19;1-20-18-10-8-15-11-17(9-7-16(15)12-18)19-13-14-5-3-2-4-6-14;1-8(2)11-7-18-20-13(15)4-12(19-14(11)20)9-3-10(16)6-17-5-9;2*1-13-11-5-3-8-6-10(12)4-2-9(8)7-11;11-9-3-1-8-6-10(12)4-2-7(8)5-9;8-6-7-4-2-1-3-5-7;;;;;/h2*4,6-7,9-14,19,28,31H,3,5,8H2,1-2H3;2-6,8,10,12,17,19H,7,9,11,13H2,1H3;3-8H,1-2H3;3,5,7,10H,2,4,6,12H2,1H3;3,5,7H,2,4,6H2,1H3;2,4,6,9,12H,1,3,5,11H2;1-5H,6,8H2;5*1H4/t19-;;;;;;;;;;;;/m1............/s1.
What are the key properties of 6-amino-5,6,7,8-tetrahydronaphthalen-2-ol;N-benzyl-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;7-chloro-5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidine;6-[[5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]amino]-5,6,7,8-tetrahydronaphthalen-2-ol;(6R)-6-[[5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]amino]-5,6,7,8-tetrahydronaphthalen-2-ol;methane;6-methoxy-3,4-dihydro-1H-naphthalen-2-one;6-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;phenylmethanamine?
6-amino-5,6,7,8-tetrahydronaphthalen-2-ol;N-benzyl-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;7-chloro-5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidine;6-[[5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]amino]-5,6,7,8-tetrahydronaphthalen-2-ol;(6R)-6-[[5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]amino]-5,6,7,8-tetrahydronaphthalen-2-ol;methane;6-methoxy-3,4-dihydro-1H-naphthalen-2-one;6-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;phenylmethanamine has a molecular weight of 2097.13 g/mol, XLogP of 25.31, 17 rotatable bonds, 9 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-5,6,7,8-tetrahydronaphthalen-2-ol;N-benzyl-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;7-chloro-5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidine;6-[[5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]amino]-5,6,7,8-tetrahydronaphthalen-2-ol;(6R)-6-[[5-(5-fluoro-3-pyridinyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]amino]-5,6,7,8-tetrahydronaphthalen-2-ol;methane;6-methoxy-3,4-dihydro-1H-naphthalen-2-one;6-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;phenylmethanamine is sourced from PubChem (CID 159409778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).