2-(4-amino-4-methylpiperidin-1-yl)-6-(2,3-dichlorophenyl)imidazo[1,2-a]pyrazin-5-amine

C18H20Cl2N6 — CID 156701788

IUPAC2-(4-amino-4-methylpiperidin-1-yl)-6-(2,3-dichlorophenyl)imidazo[1,2-a]pyrazin-5-amine
SMILESCC1(N)CCN(c2cn3c(N)c(-c4cccc(Cl)c4Cl)ncc3n2)CC1
InChIInChI=1S/C18H20Cl2N6/c1-18(22)5-7-25(8-6-18)14-10-26-13(24-14)9-23-16(17(26)21)11-3-2-4-12(19)15(11)20/h2-4,9-10H,5-8,21-22H2,1H3
InChIKeyLTRPZTASXGUVPD-UHFFFAOYSA-N
MW391.31 g/mol
LogP3.60
Rot. Bonds2

About 2-(4-amino-4-methylpiperidin-1-yl)-6-(2,3-dichlorophenyl)imidazo[1,2-a]pyrazin-5-amine

2-(4-amino-4-methylpiperidin-1-yl)-6-(2,3-dichlorophenyl)imidazo[1,2-a]pyrazin-5-amine (PubChem CID 156701788) has the molecular formula C18H20Cl2N6 and a molecular weight of 391.31 g/mol. Its IUPAC name is 2-(4-amino-4-methylpiperidin-1-yl)-6-(2,3-dichlorophenyl)imidazo[1,2-a]pyrazin-5-amine.

Molecular Properties

Compound Name2-(4-amino-4-methylpiperidin-1-yl)-6-(2,3-dichlorophenyl)imidazo[1,2-a]pyrazin-5-amine
PubChem CID156701788
Molecular FormulaC18H20Cl2N6
Molecular Weight391.31 g/mol
Exact Mass390.11
IUPAC Name2-(4-amino-4-methylpiperidin-1-yl)-6-(2,3-dichlorophenyl)imidazo[1,2-a]pyrazin-5-amine
SMILESCC1(N)CCN(c2cn3c(N)c(-c4cccc(Cl)c4Cl)ncc3n2)CC1
InChIInChI=1S/C18H20Cl2N6/c1-18(22)5-7-25(8-6-18)14-10-26-13(24-14)9-23-16(17(26)21)11-3-2-4-12(19)15(11)20/h2-4,9-10H,5-8,21-22H2,1H3
InChIKeyLTRPZTASXGUVPD-UHFFFAOYSA-N
XLogP3.60
TPSA85.47 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.31
LogP ≤ 53.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

6-[(4-amino-4-methylpiperidin-1-yl)methyl]-3-(2,3-dichlorophenyl)pyrazin-2-amine
CID 167432571
1-[[5-(2,3-dichlorophenyl)-6-methylpyrazin-2-yl]methyl]-4-methylpiperidin-4-amine
CID 134182766
3-(2,3-dichlorophenyl)-6-[4-(ethylamino)-4-methylpiperidin-1-yl]pyrazin-2-amine
CID 167296773
2-(4-amino-4-methylpiperidin-1-yl)-5-(2,3-dichlorophenyl)-1,3-oxazol-4-amine
CID 156701789
(3R)-1-[6-amino-5-(2,3-dichlorophenyl)pyrazin-2-yl]-4,4-dimethylpiperidin-3-ol
CID 161181664
6-[(3S)-3-(2-aminoethyl)-3-methylpyrrolidin-1-yl]-3-(2,3-dichlorophenyl)pyrazin-2-amine
CID 126480959
(3S,4R)-1-[6-amino-5-(2,3-dichlorophenyl)pyrazin-2-yl]-4-(aminomethyl)-4-methylpiperidin-3-ol
CID 91824802
[1-[5-(2,3-dichlorophenyl)-6-methylpyrazin-2-yl]-3-methylazetidin-3-yl]azanium
CID 147973529
6-(2,3-dichlorophenyl)-3-(4,4-dimethylpiperidin-1-yl)-1,2,4-triazin-5-amine
CID 160542934
1-[1-(2,3-dichlorophenyl)pyrazolo[3,4-b]pyrazin-5-yl]-4-methylpiperidin-4-amine
CID 167304888
6-[4-(aminomethyl)-4-pyridin-2-ylpiperidin-1-yl]-3-(2,3-dichlorophenyl)pyrazin-2-amine
CID 118249470
6-(4,9-diazadispiro[2.1.25.33]decan-9-yl)-3-(2,3-dichlorophenyl)pyrazin-2-amine
CID 163880923

Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-4-methylpiperidin-1-yl)-6-(2,3-dichlorophenyl)imidazo[1,2-a]pyrazin-5-amine?
The IUPAC name of 2-(4-amino-4-methylpiperidin-1-yl)-6-(2,3-dichlorophenyl)imidazo[1,2-a]pyrazin-5-amine (CID 156701788) is 2-(4-amino-4-methylpiperidin-1-yl)-6-(2,3-dichlorophenyl)imidazo[1,2-a]pyrazin-5-amine.
What is the SMILES notation for 2-(4-amino-4-methylpiperidin-1-yl)-6-(2,3-dichlorophenyl)imidazo[1,2-a]pyrazin-5-amine?
The canonical SMILES for 2-(4-amino-4-methylpiperidin-1-yl)-6-(2,3-dichlorophenyl)imidazo[1,2-a]pyrazin-5-amine is CC1(N)CCN(c2cn3c(N)c(-c4cccc(Cl)c4Cl)ncc3n2)CC1.
What is the InChIKey of 2-(4-amino-4-methylpiperidin-1-yl)-6-(2,3-dichlorophenyl)imidazo[1,2-a]pyrazin-5-amine?
The InChIKey is LTRPZTASXGUVPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20Cl2N6/c1-18(22)5-7-25(8-6-18)14-10-26-13(24-14)9-23-16(17(26)21)11-3-2-4-12(19)15(11)20/h2-4,9-10H,5-8,21-22H2,1H3.
What are the key properties of 2-(4-amino-4-methylpiperidin-1-yl)-6-(2,3-dichlorophenyl)imidazo[1,2-a]pyrazin-5-amine?
2-(4-amino-4-methylpiperidin-1-yl)-6-(2,3-dichlorophenyl)imidazo[1,2-a]pyrazin-5-amine has a molecular weight of 391.31 g/mol, XLogP of 3.60, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-amino-4-methylpiperidin-1-yl)-6-(2,3-dichlorophenyl)imidazo[1,2-a]pyrazin-5-amine is sourced from PubChem (CID 156701788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).