7-(2,2-dimethylpropyl)-5-piperidin-1-yl-2,6,8,9-tetrahydropyrazolo[3,4-c][2,7]naphthyridin-1-amine

C19H30N6 — CID 46887949

IUPAC7-(2,2-dimethylpropyl)-5-piperidin-1-yl-2,6,8,9-tetrahydropyrazolo[3,4-c][2,7]naphthyridin-1-amine
SMILESCC(C)(C)CN1CCc2c(c(N3CCCCC3)nc3n[nH]c(N)c23)C1
InChIInChI=1S/C19H30N6/c1-19(2,3)12-24-10-7-13-14(11-24)18(25-8-5-4-6-9-25)21-17-15(13)16(20)22-23-17/h4-12H2,1-3H3,(H3,20,21,22,23)
InChIKeyZYPFDZVGEMPHMZ-UHFFFAOYSA-N
MW342.49 g/mol
LogP2.93
Rot. Bonds2

About 7-(2,2-dimethylpropyl)-5-piperidin-1-yl-2,6,8,9-tetrahydropyrazolo[3,4-c][2,7]naphthyridin-1-amine

7-(2,2-dimethylpropyl)-5-piperidin-1-yl-2,6,8,9-tetrahydropyrazolo[3,4-c][2,7]naphthyridin-1-amine (PubChem CID 46887949) has the molecular formula C19H30N6 and a molecular weight of 342.49 g/mol. Its IUPAC name is 7-(2,2-dimethylpropyl)-5-piperidin-1-yl-2,6,8,9-tetrahydropyrazolo[3,4-c][2,7]naphthyridin-1-amine.

Molecular Properties

Compound Name7-(2,2-dimethylpropyl)-5-piperidin-1-yl-2,6,8,9-tetrahydropyrazolo[3,4-c][2,7]naphthyridin-1-amine
PubChem CID46887949
Molecular FormulaC19H30N6
Molecular Weight342.49 g/mol
Exact Mass342.25
IUPAC Name7-(2,2-dimethylpropyl)-5-piperidin-1-yl-2,6,8,9-tetrahydropyrazolo[3,4-c][2,7]naphthyridin-1-amine
SMILESCC(C)(C)CN1CCc2c(c(N3CCCCC3)nc3n[nH]c(N)c23)C1
InChIInChI=1S/C19H30N6/c1-19(2,3)12-24-10-7-13-14(11-24)18(25-8-5-4-6-9-25)21-17-15(13)16(20)22-23-17/h4-12H2,1-3H3,(H3,20,21,22,23)
InChIKeyZYPFDZVGEMPHMZ-UHFFFAOYSA-N
XLogP2.93
TPSA74.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.49
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-(2,2-dimethylpropyl)-5-piperidin-1-yl-2,6,8,9-tetrahydropyrazolo[3,4-c][2,7]naphthyridin-1-amine?
The IUPAC name of 7-(2,2-dimethylpropyl)-5-piperidin-1-yl-2,6,8,9-tetrahydropyrazolo[3,4-c][2,7]naphthyridin-1-amine (CID 46887949) is 7-(2,2-dimethylpropyl)-5-piperidin-1-yl-2,6,8,9-tetrahydropyrazolo[3,4-c][2,7]naphthyridin-1-amine.
What is the SMILES notation for 7-(2,2-dimethylpropyl)-5-piperidin-1-yl-2,6,8,9-tetrahydropyrazolo[3,4-c][2,7]naphthyridin-1-amine?
The canonical SMILES for 7-(2,2-dimethylpropyl)-5-piperidin-1-yl-2,6,8,9-tetrahydropyrazolo[3,4-c][2,7]naphthyridin-1-amine is CC(C)(C)CN1CCc2c(c(N3CCCCC3)nc3n[nH]c(N)c23)C1.
What is the InChIKey of 7-(2,2-dimethylpropyl)-5-piperidin-1-yl-2,6,8,9-tetrahydropyrazolo[3,4-c][2,7]naphthyridin-1-amine?
The InChIKey is ZYPFDZVGEMPHMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N6/c1-19(2,3)12-24-10-7-13-14(11-24)18(25-8-5-4-6-9-25)21-17-15(13)16(20)22-23-17/h4-12H2,1-3H3,(H3,20,21,22,23).
What are the key properties of 7-(2,2-dimethylpropyl)-5-piperidin-1-yl-2,6,8,9-tetrahydropyrazolo[3,4-c][2,7]naphthyridin-1-amine?
7-(2,2-dimethylpropyl)-5-piperidin-1-yl-2,6,8,9-tetrahydropyrazolo[3,4-c][2,7]naphthyridin-1-amine has a molecular weight of 342.49 g/mol, XLogP of 2.93, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2,2-dimethylpropyl)-5-piperidin-1-yl-2,6,8,9-tetrahydropyrazolo[3,4-c][2,7]naphthyridin-1-amine is sourced from PubChem (CID 46887949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).