6-[1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-N-pyrazin-2-ylpyrazin-2-amine

C21H24N6O — CID 110094104

IUPAC6-[1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-N-pyrazin-2-ylpyrazin-2-amine
SMILESCOc1cccc(CN2CCC(c3cncc(Nc4cnccn4)n3)CC2)c1
InChIInChI=1S/C21H24N6O/c1-28-18-4-2-3-16(11-18)15-27-9-5-17(6-10-27)19-12-23-14-21(25-19)26-20-13-22-7-8-24-20/h2-4,7-8,11-14,17H,5-6,9-10,15H2,1H3,(H,24,25,26)
InChIKeyYDGOVCDCTQFMAT-UHFFFAOYSA-N
MW376.46 g/mol
LogP3.40
Rot. Bonds6

About 6-[1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-N-pyrazin-2-ylpyrazin-2-amine

6-[1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-N-pyrazin-2-ylpyrazin-2-amine (PubChem CID 110094104) has the molecular formula C21H24N6O and a molecular weight of 376.46 g/mol. Its IUPAC name is 6-[1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-N-pyrazin-2-ylpyrazin-2-amine.

Molecular Properties

Compound Name6-[1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-N-pyrazin-2-ylpyrazin-2-amine
PubChem CID110094104
Molecular FormulaC21H24N6O
Molecular Weight376.46 g/mol
Exact Mass376.20
IUPAC Name6-[1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-N-pyrazin-2-ylpyrazin-2-amine
SMILESCOc1cccc(CN2CCC(c3cncc(Nc4cnccn4)n3)CC2)c1
InChIInChI=1S/C21H24N6O/c1-28-18-4-2-3-16(11-18)15-27-9-5-17(6-10-27)19-12-23-14-21(25-19)26-20-13-22-7-8-24-20/h2-4,7-8,11-14,17H,5-6,9-10,15H2,1H3,(H,24,25,26)
InChIKeyYDGOVCDCTQFMAT-UHFFFAOYSA-N
XLogP3.40
TPSA76.06 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 6-[1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-N-pyrazin-2-ylpyrazin-2-amine 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

6-(1-benzylpiperidin-4-yl)-N-pyrimidin-2-ylpyrazin-2-amine
CID 155983124
N-[6-[1-[(2,6-dimethoxyphenyl)methyl]piperidin-4-yl]pyrazin-2-yl]-4,6-dimethylpyrimidin-2-amine
CID 110094212
2-(3-methoxyphenoxy)-1-[4-[6-(pyrazin-2-ylamino)-2-pyridinyl]piperidin-1-yl]butan-1-one
CID 110093928
4-chloro-1-[(3-methoxyphenyl)methyl]piperidine
CID 63389704
2-[(3-methoxyphenyl)methyl-methylamino]-1-[(3S)-3-[6-(pyrazin-2-ylamino)-2-pyridinyl]piperidin-1-yl]ethanone
CID 124946146
2-(3-methoxyphenyl)-6-[1-(2-phenylethyl)piperidin-4-yl]pyrazine
CID 95819598
1-[(3-methoxyphenyl)methyl]-N-methylpyrrolidin-3-amine
CID 61029194
5-[1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-3-methyl-1,2,4-oxadiazole
CID 75462107
N-[1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-N,5-dimethylpyrimidin-2-amine
CID 171328544
4-[1-[(3-methoxyphenyl)methyl]piperidin-4-yl]phenol
CID 78833986
5-[2-(4-methoxyphenoxy)ethyl]-3-[(3R)-1-[(3-methoxyphenyl)methyl]pyrrolidin-3-yl]-1H-pyrazole
CID 95831365
6-[1-[(1-methylindol-3-yl)methyl]piperidin-4-yl]-N-pyridin-2-ylpyrazin-2-amine
CID 110094277

Frequently Asked Questions

What is the IUPAC name of 6-[1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-N-pyrazin-2-ylpyrazin-2-amine?
The IUPAC name of 6-[1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-N-pyrazin-2-ylpyrazin-2-amine (CID 110094104) is 6-[1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-N-pyrazin-2-ylpyrazin-2-amine.
What is the SMILES notation for 6-[1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-N-pyrazin-2-ylpyrazin-2-amine?
The canonical SMILES for 6-[1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-N-pyrazin-2-ylpyrazin-2-amine is COc1cccc(CN2CCC(c3cncc(Nc4cnccn4)n3)CC2)c1.
What is the InChIKey of 6-[1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-N-pyrazin-2-ylpyrazin-2-amine?
The InChIKey is YDGOVCDCTQFMAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N6O/c1-28-18-4-2-3-16(11-18)15-27-9-5-17(6-10-27)19-12-23-14-21(25-19)26-20-13-22-7-8-24-20/h2-4,7-8,11-14,17H,5-6,9-10,15H2,1H3,(H,24,25,26).
What are the key properties of 6-[1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-N-pyrazin-2-ylpyrazin-2-amine?
6-[1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-N-pyrazin-2-ylpyrazin-2-amine has a molecular weight of 376.46 g/mol, XLogP of 3.40, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-N-pyrazin-2-ylpyrazin-2-amine is sourced from PubChem (CID 110094104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).