N-(1-methylpyrrolidin-3-yl)-6-[6-(1,1,1-trifluoro-2-methylpropan-2-yl)imidazo[1,2-a]pyrazin-3-yl]pyrazin-2-amine

C19H22F3N7 — CID 170591614

IUPACN-(1-methylpyrrolidin-3-yl)-6-[6-(1,1,1-trifluoro-2-methylpropan-2-yl)imidazo[1,2-a]pyrazin-3-yl]pyrazin-2-amine
SMILESCN1CCC(Nc2cncc(-c3cnc4cnc(C(C)(C)C(F)(F)F)cn34)n2)C1
InChIInChI=1S/C19H22F3N7/c1-18(2,19(20,21)22)15-11-29-14(7-25-17(29)9-24-15)13-6-23-8-16(27-13)26-12-4-5-28(3)10-12/h6-9,11-12H,4-5,10H2,1-3H3,(H,26,27)
InChIKeyCVVPGGDDWXZEKC-UHFFFAOYSA-N
MW405.43 g/mol
LogP3.14
Rot. Bonds4

About N-(1-methylpyrrolidin-3-yl)-6-[6-(1,1,1-trifluoro-2-methylpropan-2-yl)imidazo[1,2-a]pyrazin-3-yl]pyrazin-2-amine

N-(1-methylpyrrolidin-3-yl)-6-[6-(1,1,1-trifluoro-2-methylpropan-2-yl)imidazo[1,2-a]pyrazin-3-yl]pyrazin-2-amine (PubChem CID 170591614) has the molecular formula C19H22F3N7 and a molecular weight of 405.43 g/mol. Its IUPAC name is N-(1-methylpyrrolidin-3-yl)-6-[6-(1,1,1-trifluoro-2-methylpropan-2-yl)imidazo[1,2-a]pyrazin-3-yl]pyrazin-2-amine.

Molecular Properties

Compound NameN-(1-methylpyrrolidin-3-yl)-6-[6-(1,1,1-trifluoro-2-methylpropan-2-yl)imidazo[1,2-a]pyrazin-3-yl]pyrazin-2-amine
PubChem CID170591614
Molecular FormulaC19H22F3N7
Molecular Weight405.43 g/mol
Exact Mass405.19
IUPAC NameN-(1-methylpyrrolidin-3-yl)-6-[6-(1,1,1-trifluoro-2-methylpropan-2-yl)imidazo[1,2-a]pyrazin-3-yl]pyrazin-2-amine
SMILESCN1CCC(Nc2cncc(-c3cnc4cnc(C(C)(C)C(F)(F)F)cn34)n2)C1
InChIInChI=1S/C19H22F3N7/c1-18(2,19(20,21)22)15-11-29-14(7-25-17(29)9-24-15)13-6-23-8-16(27-13)26-12-4-5-28(3)10-12/h6-9,11-12H,4-5,10H2,1-3H3,(H,26,27)
InChIKeyCVVPGGDDWXZEKC-UHFFFAOYSA-N
XLogP3.14
TPSA71.24 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.43
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-(1-methylpyrrolidin-3-yl)-6-[6-(1,1,1-trifluoro-2-methylpropan-2-yl)imidazo[1,2-a]pyrazin-3-yl]pyrazin-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

Frequently Asked Questions

What is the IUPAC name of N-(1-methylpyrrolidin-3-yl)-6-[6-(1,1,1-trifluoro-2-methylpropan-2-yl)imidazo[1,2-a]pyrazin-3-yl]pyrazin-2-amine?
The IUPAC name of N-(1-methylpyrrolidin-3-yl)-6-[6-(1,1,1-trifluoro-2-methylpropan-2-yl)imidazo[1,2-a]pyrazin-3-yl]pyrazin-2-amine (CID 170591614) is N-(1-methylpyrrolidin-3-yl)-6-[6-(1,1,1-trifluoro-2-methylpropan-2-yl)imidazo[1,2-a]pyrazin-3-yl]pyrazin-2-amine.
What is the SMILES notation for N-(1-methylpyrrolidin-3-yl)-6-[6-(1,1,1-trifluoro-2-methylpropan-2-yl)imidazo[1,2-a]pyrazin-3-yl]pyrazin-2-amine?
The canonical SMILES for N-(1-methylpyrrolidin-3-yl)-6-[6-(1,1,1-trifluoro-2-methylpropan-2-yl)imidazo[1,2-a]pyrazin-3-yl]pyrazin-2-amine is CN1CCC(Nc2cncc(-c3cnc4cnc(C(C)(C)C(F)(F)F)cn34)n2)C1.
What is the InChIKey of N-(1-methylpyrrolidin-3-yl)-6-[6-(1,1,1-trifluoro-2-methylpropan-2-yl)imidazo[1,2-a]pyrazin-3-yl]pyrazin-2-amine?
The InChIKey is CVVPGGDDWXZEKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22F3N7/c1-18(2,19(20,21)22)15-11-29-14(7-25-17(29)9-24-15)13-6-23-8-16(27-13)26-12-4-5-28(3)10-12/h6-9,11-12H,4-5,10H2,1-3H3,(H,26,27).
What are the key properties of N-(1-methylpyrrolidin-3-yl)-6-[6-(1,1,1-trifluoro-2-methylpropan-2-yl)imidazo[1,2-a]pyrazin-3-yl]pyrazin-2-amine?
N-(1-methylpyrrolidin-3-yl)-6-[6-(1,1,1-trifluoro-2-methylpropan-2-yl)imidazo[1,2-a]pyrazin-3-yl]pyrazin-2-amine has a molecular weight of 405.43 g/mol, XLogP of 3.14, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methylpyrrolidin-3-yl)-6-[6-(1,1,1-trifluoro-2-methylpropan-2-yl)imidazo[1,2-a]pyrazin-3-yl]pyrazin-2-amine is sourced from PubChem (CID 170591614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).