(4R)-8-[6-amino-5-(2,3-dichlorophenyl)pyrazin-2-yl]-8-azaspiro[4.5]decan-4-amine

C19H23Cl2N5 — CID 125495840

IUPAC(4R)-8-[6-amino-5-(2,3-dichlorophenyl)pyrazin-2-yl]-8-azaspiro[4.5]decan-4-amine
SMILESNc1nc(N2CCC3(CCC[C@H]3N)CC2)cnc1-c1cccc(Cl)c1Cl
InChIInChI=1S/C19H23Cl2N5/c20-13-4-1-3-12(16(13)21)17-18(23)25-15(11-24-17)26-9-7-19(8-10-26)6-2-5-14(19)22/h1,3-4,11,14H,2,5-10,22H2,(H2,23,25)/t14-/m1/s1
InChIKeyDYZZCXHBYCBNEC-CQSZACIVSA-N
MW392.33 g/mol
LogP4.13
Rot. Bonds2

About (4R)-8-[6-amino-5-(2,3-dichlorophenyl)pyrazin-2-yl]-8-azaspiro[4.5]decan-4-amine

(4R)-8-[6-amino-5-(2,3-dichlorophenyl)pyrazin-2-yl]-8-azaspiro[4.5]decan-4-amine (PubChem CID 125495840) has the molecular formula C19H23Cl2N5 and a molecular weight of 392.33 g/mol. Its IUPAC name is (4R)-8-[6-amino-5-(2,3-dichlorophenyl)pyrazin-2-yl]-8-azaspiro[4.5]decan-4-amine.

Molecular Properties

Compound Name(4R)-8-[6-amino-5-(2,3-dichlorophenyl)pyrazin-2-yl]-8-azaspiro[4.5]decan-4-amine
PubChem CID125495840
Molecular FormulaC19H23Cl2N5
Molecular Weight392.33 g/mol
Exact Mass391.13
IUPAC Name(4R)-8-[6-amino-5-(2,3-dichlorophenyl)pyrazin-2-yl]-8-azaspiro[4.5]decan-4-amine
SMILESNc1nc(N2CCC3(CCC[C@H]3N)CC2)cnc1-c1cccc(Cl)c1Cl
InChIInChI=1S/C19H23Cl2N5/c20-13-4-1-3-12(16(13)21)17-18(23)25-15(11-24-17)26-9-7-19(8-10-26)6-2-5-14(19)22/h1,3-4,11,14H,2,5-10,22H2,(H2,23,25)/t14-/m1/s1
InChIKeyDYZZCXHBYCBNEC-CQSZACIVSA-N
XLogP4.13
TPSA81.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.33
LogP ≤ 54.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze (4R)-8-[6-amino-5-(2,3-dichlorophenyl)pyrazin-2-yl]-8-azaspiro[4.5]decan-4-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-(4-Amino-4-methylpiperidin-1-yl)-3-(2,3-dichlorophenyl)pyrazin-2-amine
CID 118238298
Elpetrigine
CID 9926001
Pyrazine-Pyridine Biheteroaryl 40
CID 5330369
Pyrazine-Pyridine Biheteroaryl 41
CID 5330389
(E)-1-(3,4-dichlorophenyl)-3-(4-pyridin-2-ylpiperazin-1-yl)-propan-1-one O-methyloxime
CID 11200205
(Z)-1-(3,4-dichlorophenyl)-3-(4-pyridin-2-ylpiperazin-1-yl)-propan-1-one O-methyloxime
CID 11849780
5-(2,4-dichlorophenyl)-6-ethyl-N-pentan-3-ylpyrazin-2-amine
CID 22249074
US10093646, Example 8
CID 118249463
US10093646, Example 9
CID 118249464
(4R)-8-[5-(2,3-dichlorophenyl)-6-methylimidazo[1,5-a]pyrazin-8-yl]-8-azaspiro[4.5]decan-4-amine
CID 153313142
5-[[1-[6-amino-5-(2,3-dichlorophenyl)pyrazin-2-yl]-4-methylpiperidin-4-yl]amino]-N-hydroxypentanamide
CID 168289784
4-N-[5-chloro-4-[6-[(2-chlorophenyl)methylamino]-2-pyridinyl]-2-pyridinyl]cyclohexane-1,4-diamine
CID 68405064

Frequently Asked Questions

What is the IUPAC name of (4R)-8-[6-amino-5-(2,3-dichlorophenyl)pyrazin-2-yl]-8-azaspiro[4.5]decan-4-amine?
The IUPAC name of (4R)-8-[6-amino-5-(2,3-dichlorophenyl)pyrazin-2-yl]-8-azaspiro[4.5]decan-4-amine (CID 125495840) is (4R)-8-[6-amino-5-(2,3-dichlorophenyl)pyrazin-2-yl]-8-azaspiro[4.5]decan-4-amine.
What is the SMILES notation for (4R)-8-[6-amino-5-(2,3-dichlorophenyl)pyrazin-2-yl]-8-azaspiro[4.5]decan-4-amine?
The canonical SMILES for (4R)-8-[6-amino-5-(2,3-dichlorophenyl)pyrazin-2-yl]-8-azaspiro[4.5]decan-4-amine is Nc1nc(N2CCC3(CCC[C@H]3N)CC2)cnc1-c1cccc(Cl)c1Cl.
What is the InChIKey of (4R)-8-[6-amino-5-(2,3-dichlorophenyl)pyrazin-2-yl]-8-azaspiro[4.5]decan-4-amine?
The InChIKey is DYZZCXHBYCBNEC-CQSZACIVSA-N. The full InChI is InChI=1S/C19H23Cl2N5/c20-13-4-1-3-12(16(13)21)17-18(23)25-15(11-24-17)26-9-7-19(8-10-26)6-2-5-14(19)22/h1,3-4,11,14H,2,5-10,22H2,(H2,23,25)/t14-/m1/s1.
What are the key properties of (4R)-8-[6-amino-5-(2,3-dichlorophenyl)pyrazin-2-yl]-8-azaspiro[4.5]decan-4-amine?
(4R)-8-[6-amino-5-(2,3-dichlorophenyl)pyrazin-2-yl]-8-azaspiro[4.5]decan-4-amine has a molecular weight of 392.33 g/mol, XLogP of 4.13, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-8-[6-amino-5-(2,3-dichlorophenyl)pyrazin-2-yl]-8-azaspiro[4.5]decan-4-amine is sourced from PubChem (CID 125495840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).