N-[(1-propan-2-ylpyrazolo[5,4-b]pyridin-5-yl)methyl]-1-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine

C18H24N6 — CID 129475227

IUPACN-[(1-propan-2-ylpyrazolo[5,4-b]pyridin-5-yl)methyl]-1-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine
SMILESCC(C)n1ncc2cc(CNC[C@@H]3CCc4nccn4C3)cnc21
InChIInChI=1S/C18H24N6/c1-13(2)24-18-16(11-22-24)7-15(10-21-18)9-19-8-14-3-4-17-20-5-6-23(17)12-14/h5-7,10-11,13-14,19H,3-4,8-9,12H2,1-2H3/t14-/m0/s1
InChIKeyRENFZPXMKSLHFA-AWEZNQCLSA-N
MW324.43 g/mol
LogP2.56
Rot. Bonds5

About N-[(1-propan-2-ylpyrazolo[5,4-b]pyridin-5-yl)methyl]-1-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine

N-[(1-propan-2-ylpyrazolo[5,4-b]pyridin-5-yl)methyl]-1-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine (PubChem CID 129475227) has the molecular formula C18H24N6 and a molecular weight of 324.43 g/mol. Its IUPAC name is N-[(1-propan-2-ylpyrazolo[5,4-b]pyridin-5-yl)methyl]-1-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine.

Molecular Properties

Compound NameN-[(1-propan-2-ylpyrazolo[5,4-b]pyridin-5-yl)methyl]-1-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine
PubChem CID129475227
Molecular FormulaC18H24N6
Molecular Weight324.43 g/mol
Exact Mass324.21
IUPAC NameN-[(1-propan-2-ylpyrazolo[5,4-b]pyridin-5-yl)methyl]-1-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine
SMILESCC(C)n1ncc2cc(CNC[C@@H]3CCc4nccn4C3)cnc21
InChIInChI=1S/C18H24N6/c1-13(2)24-18-16(11-22-24)7-15(10-21-18)9-19-8-14-3-4-17-20-5-6-23(17)12-14/h5-7,10-11,13-14,19H,3-4,8-9,12H2,1-2H3/t14-/m0/s1
InChIKeyRENFZPXMKSLHFA-AWEZNQCLSA-N
XLogP2.56
TPSA60.56 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[(1-propan-2-ylpyrazolo[5,4-b]pyridin-5-yl)methyl]-1-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[(1-propan-2-ylpyrazolo[5,4-b]pyridin-5-yl)methyl]-1-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine?
The IUPAC name of N-[(1-propan-2-ylpyrazolo[5,4-b]pyridin-5-yl)methyl]-1-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine (CID 129475227) is N-[(1-propan-2-ylpyrazolo[5,4-b]pyridin-5-yl)methyl]-1-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine.
What is the SMILES notation for N-[(1-propan-2-ylpyrazolo[5,4-b]pyridin-5-yl)methyl]-1-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine?
The canonical SMILES for N-[(1-propan-2-ylpyrazolo[5,4-b]pyridin-5-yl)methyl]-1-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine is CC(C)n1ncc2cc(CNC[C@@H]3CCc4nccn4C3)cnc21.
What is the InChIKey of N-[(1-propan-2-ylpyrazolo[5,4-b]pyridin-5-yl)methyl]-1-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine?
The InChIKey is RENFZPXMKSLHFA-AWEZNQCLSA-N. The full InChI is InChI=1S/C18H24N6/c1-13(2)24-18-16(11-22-24)7-15(10-21-18)9-19-8-14-3-4-17-20-5-6-23(17)12-14/h5-7,10-11,13-14,19H,3-4,8-9,12H2,1-2H3/t14-/m0/s1.
What are the key properties of N-[(1-propan-2-ylpyrazolo[5,4-b]pyridin-5-yl)methyl]-1-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine?
N-[(1-propan-2-ylpyrazolo[5,4-b]pyridin-5-yl)methyl]-1-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine has a molecular weight of 324.43 g/mol, XLogP of 2.56, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-propan-2-ylpyrazolo[5,4-b]pyridin-5-yl)methyl]-1-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine is sourced from PubChem (CID 129475227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).