1-methyl-2-(7-methyl-1H-indazol-5-yl)piperidin-4-amine

C14H20N4 — CID 82385475

IUPAC1-methyl-2-(7-methyl-1H-indazol-5-yl)piperidin-4-amine
SMILESCc1cc(C2CC(N)CCN2C)cc2cn[nH]c12
InChIInChI=1S/C14H20N4/c1-9-5-10(6-11-8-16-17-14(9)11)13-7-12(15)3-4-18(13)2/h5-6,8,12-13H,3-4,7,15H2,1-2H3,(H,16,17)
InChIKeyIREMUHOWTBNCPM-UHFFFAOYSA-N
MW244.34 g/mol
LogP1.97
Rot. Bonds1

About 1-methyl-2-(7-methyl-1H-indazol-5-yl)piperidin-4-amine

1-methyl-2-(7-methyl-1H-indazol-5-yl)piperidin-4-amine (PubChem CID 82385475) has the molecular formula C14H20N4 and a molecular weight of 244.34 g/mol. Its IUPAC name is 1-methyl-2-(7-methyl-1H-indazol-5-yl)piperidin-4-amine.

Molecular Properties

Compound Name1-methyl-2-(7-methyl-1H-indazol-5-yl)piperidin-4-amine
PubChem CID82385475
Molecular FormulaC14H20N4
Molecular Weight244.34 g/mol
Exact Mass244.17
IUPAC Name1-methyl-2-(7-methyl-1H-indazol-5-yl)piperidin-4-amine
SMILESCc1cc(C2CC(N)CCN2C)cc2cn[nH]c12
InChIInChI=1S/C14H20N4/c1-9-5-10(6-11-8-16-17-14(9)11)13-7-12(15)3-4-18(13)2/h5-6,8,12-13H,3-4,7,15H2,1-2H3,(H,16,17)
InChIKeyIREMUHOWTBNCPM-UHFFFAOYSA-N
XLogP1.97
TPSA57.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-(7-methyl-1H-indazol-5-yl)piperidin-4-amine?
The IUPAC name of 1-methyl-2-(7-methyl-1H-indazol-5-yl)piperidin-4-amine (CID 82385475) is 1-methyl-2-(7-methyl-1H-indazol-5-yl)piperidin-4-amine.
What is the SMILES notation for 1-methyl-2-(7-methyl-1H-indazol-5-yl)piperidin-4-amine?
The canonical SMILES for 1-methyl-2-(7-methyl-1H-indazol-5-yl)piperidin-4-amine is Cc1cc(C2CC(N)CCN2C)cc2cn[nH]c12.
What is the InChIKey of 1-methyl-2-(7-methyl-1H-indazol-5-yl)piperidin-4-amine?
The InChIKey is IREMUHOWTBNCPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4/c1-9-5-10(6-11-8-16-17-14(9)11)13-7-12(15)3-4-18(13)2/h5-6,8,12-13H,3-4,7,15H2,1-2H3,(H,16,17).
What are the key properties of 1-methyl-2-(7-methyl-1H-indazol-5-yl)piperidin-4-amine?
1-methyl-2-(7-methyl-1H-indazol-5-yl)piperidin-4-amine has a molecular weight of 244.34 g/mol, XLogP of 1.97, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-(7-methyl-1H-indazol-5-yl)piperidin-4-amine is sourced from PubChem (CID 82385475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).