N-methyl-2-[2-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanamine

C26H27N9 — CID 167366629

IUPACN-methyl-2-[2-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanamine
SMILESCNCCN1CCn2cc(-c3cnc4ccc(-c5cn[nH]c5-c5cccc(C)n5)nc4c3)nc2C1
InChIInChI=1S/C26H27N9/c1-17-4-3-5-22(30-17)26-19(14-29-33-26)20-6-7-21-23(31-20)12-18(13-28-21)24-15-35-11-10-34(9-8-27-2)16-25(35)32-24/h3-7,12-15,27H,8-11,16H2,1-2H3,(H,29,33)
InChIKeyYVCPXAHHIUUERU-UHFFFAOYSA-N
MW465.57 g/mol
LogP3.29
Rot. Bonds6

About N-methyl-2-[2-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanamine

N-methyl-2-[2-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanamine (PubChem CID 167366629) has the molecular formula C26H27N9 and a molecular weight of 465.57 g/mol. Its IUPAC name is N-methyl-2-[2-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanamine.

Molecular Properties

Compound NameN-methyl-2-[2-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanamine
PubChem CID167366629
Molecular FormulaC26H27N9
Molecular Weight465.57 g/mol
Exact Mass465.24
IUPAC NameN-methyl-2-[2-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanamine
SMILESCNCCN1CCn2cc(-c3cnc4ccc(-c5cn[nH]c5-c5cccc(C)n5)nc4c3)nc2C1
InChIInChI=1S/C26H27N9/c1-17-4-3-5-22(30-17)26-19(14-29-33-26)20-6-7-21-23(31-20)12-18(13-28-21)24-15-35-11-10-34(9-8-27-2)16-25(35)32-24/h3-7,12-15,27H,8-11,16H2,1-2H3,(H,29,33)
InChIKeyYVCPXAHHIUUERU-UHFFFAOYSA-N
XLogP3.29
TPSA100.44 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500465.57
LogP ≤ 53.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[2-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanamine?
The IUPAC name of N-methyl-2-[2-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanamine (CID 167366629) is N-methyl-2-[2-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanamine.
What is the SMILES notation for N-methyl-2-[2-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanamine?
The canonical SMILES for N-methyl-2-[2-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanamine is CNCCN1CCn2cc(-c3cnc4ccc(-c5cn[nH]c5-c5cccc(C)n5)nc4c3)nc2C1.
What is the InChIKey of N-methyl-2-[2-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanamine?
The InChIKey is YVCPXAHHIUUERU-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H27N9/c1-17-4-3-5-22(30-17)26-19(14-29-33-26)20-6-7-21-23(31-20)12-18(13-28-21)24-15-35-11-10-34(9-8-27-2)16-25(35)32-24/h3-7,12-15,27H,8-11,16H2,1-2H3,(H,29,33).
What are the key properties of N-methyl-2-[2-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanamine?
N-methyl-2-[2-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanamine has a molecular weight of 465.57 g/mol, XLogP of 3.29, 6 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[2-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanamine is sourced from PubChem (CID 167366629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).