[1-(2-pyrazin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)piperidin-4-yl]methanamine

C19H21N7 — CID 56768273

IUPAC[1-(2-pyrazin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)piperidin-4-yl]methanamine
SMILESNCC1CCN(c2cc(-c3cccnc3)nc(-c3cnccn3)n2)CC1
InChIInChI=1S/C19H21N7/c20-11-14-3-8-26(9-4-14)18-10-16(15-2-1-5-21-12-15)24-19(25-18)17-13-22-6-7-23-17/h1-2,5-7,10,12-14H,3-4,8-9,11,20H2
InChIKeyLLBXBAHHVHURLE-UHFFFAOYSA-N
MW347.43 g/mol
LogP2.17
Rot. Bonds4

About [1-(2-pyrazin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)piperidin-4-yl]methanamine

[1-(2-pyrazin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)piperidin-4-yl]methanamine (PubChem CID 56768273) has the molecular formula C19H21N7 and a molecular weight of 347.43 g/mol. Its IUPAC name is [1-(2-pyrazin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)piperidin-4-yl]methanamine.

Molecular Properties

Compound Name[1-(2-pyrazin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)piperidin-4-yl]methanamine
PubChem CID56768273
Molecular FormulaC19H21N7
Molecular Weight347.43 g/mol
Exact Mass347.19
IUPAC Name[1-(2-pyrazin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)piperidin-4-yl]methanamine
SMILESNCC1CCN(c2cc(-c3cccnc3)nc(-c3cnccn3)n2)CC1
InChIInChI=1S/C19H21N7/c20-11-14-3-8-26(9-4-14)18-10-16(15-2-1-5-21-12-15)24-19(25-18)17-13-22-6-7-23-17/h1-2,5-7,10,12-14H,3-4,8-9,11,20H2
InChIKeyLLBXBAHHVHURLE-UHFFFAOYSA-N
XLogP2.17
TPSA93.71 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.43
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze [1-(2-pyrazin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)piperidin-4-yl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2-pyrazin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)piperidin-4-amine
CID 56767135
1-(6-phenyl-2-pyrazin-2-ylpyrimidin-4-yl)piperidin-4-one
CID 56767355
1-[2-(3-fluorophenyl)-6-pyridin-3-ylpyrimidin-4-yl]piperidin-4-amine
CID 56767086
(1-pyrazin-2-ylpiperidin-4-yl)methanamine;dihydrochloride
CID 56965638
1-(6-propyl-2-pyrazin-2-ylpyrimidin-4-yl)piperidin-4-amine
CID 56767139
[1-[6-(2-chlorophenyl)-2-pyridin-3-ylpyrimidin-4-yl]piperidin-4-yl]methanol
CID 166514811
[1-[6-(2,4-dichlorophenyl)-2-pyridin-3-ylpyrimidin-4-yl]piperidin-4-yl]methanol
CID 156865969
N-[[3-(aminomethyl)cyclohexyl]methyl]-2-pyridin-2-yl-6-pyridin-3-ylpyrimidin-4-amine
CID 69183338
4-(4-chlorophenyl)-6-[4-(3,5-dichlorophenyl)piperazin-1-yl]-2-pyridin-3-ylpyrimidine
CID 175342188
[1-(6-pyridin-3-ylpyridazin-3-yl)piperidin-3-yl]methanamine
CID 116972450
4-(4-chlorophenyl)-6-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]-2-pyridin-3-ylpyrimidine
CID 156865958
[1-[6-(4-chlorophenyl)-2-pyridin-3-ylpyrimidin-4-yl]piperidin-4-yl] butanoate
CID 175342086

Frequently Asked Questions

What is the IUPAC name of [1-(2-pyrazin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)piperidin-4-yl]methanamine?
The IUPAC name of [1-(2-pyrazin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)piperidin-4-yl]methanamine (CID 56768273) is [1-(2-pyrazin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)piperidin-4-yl]methanamine.
What is the SMILES notation for [1-(2-pyrazin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)piperidin-4-yl]methanamine?
The canonical SMILES for [1-(2-pyrazin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)piperidin-4-yl]methanamine is NCC1CCN(c2cc(-c3cccnc3)nc(-c3cnccn3)n2)CC1.
What is the InChIKey of [1-(2-pyrazin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)piperidin-4-yl]methanamine?
The InChIKey is LLBXBAHHVHURLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N7/c20-11-14-3-8-26(9-4-14)18-10-16(15-2-1-5-21-12-15)24-19(25-18)17-13-22-6-7-23-17/h1-2,5-7,10,12-14H,3-4,8-9,11,20H2.
What are the key properties of [1-(2-pyrazin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)piperidin-4-yl]methanamine?
[1-(2-pyrazin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)piperidin-4-yl]methanamine has a molecular weight of 347.43 g/mol, XLogP of 2.17, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-pyrazin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)piperidin-4-yl]methanamine is sourced from PubChem (CID 56768273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).