N-[(3R)-pyrrolidin-3-yl]-6-[6-(2,2,2-trifluoroethoxy)imidazo[1,2-a]pyrazin-3-yl]pyridin-2-amine

C17H17F3N6O — CID 164560903

IUPACN-[(3R)-pyrrolidin-3-yl]-6-[6-(2,2,2-trifluoroethoxy)imidazo[1,2-a]pyrazin-3-yl]pyridin-2-amine
SMILESFC(F)(F)COc1cn2c(-c3cccc(N[C@@H]4CCNC4)n3)cnc2cn1
InChIInChI=1S/C17H17F3N6O/c18-17(19,20)10-27-16-9-26-13(7-22-15(26)8-23-16)12-2-1-3-14(25-12)24-11-4-5-21-6-11/h1-3,7-9,11,21H,4-6,10H2,(H,24,25)/t11-/m1/s1
InChIKeyONOMJNOWWPXADY-LLVKDONJSA-N
MW378.36 g/mol
LogP2.51
Rot. Bonds5

About N-[(3R)-pyrrolidin-3-yl]-6-[6-(2,2,2-trifluoroethoxy)imidazo[1,2-a]pyrazin-3-yl]pyridin-2-amine

N-[(3R)-pyrrolidin-3-yl]-6-[6-(2,2,2-trifluoroethoxy)imidazo[1,2-a]pyrazin-3-yl]pyridin-2-amine (PubChem CID 164560903) has the molecular formula C17H17F3N6O and a molecular weight of 378.36 g/mol. Its IUPAC name is N-[(3R)-pyrrolidin-3-yl]-6-[6-(2,2,2-trifluoroethoxy)imidazo[1,2-a]pyrazin-3-yl]pyridin-2-amine.

Molecular Properties

Compound NameN-[(3R)-pyrrolidin-3-yl]-6-[6-(2,2,2-trifluoroethoxy)imidazo[1,2-a]pyrazin-3-yl]pyridin-2-amine
PubChem CID164560903
Molecular FormulaC17H17F3N6O
Molecular Weight378.36 g/mol
Exact Mass378.14
IUPAC NameN-[(3R)-pyrrolidin-3-yl]-6-[6-(2,2,2-trifluoroethoxy)imidazo[1,2-a]pyrazin-3-yl]pyridin-2-amine
SMILESFC(F)(F)COc1cn2c(-c3cccc(N[C@@H]4CCNC4)n3)cnc2cn1
InChIInChI=1S/C17H17F3N6O/c18-17(19,20)10-27-16-9-26-13(7-22-15(26)8-23-16)12-2-1-3-14(25-12)24-11-4-5-21-6-11/h1-3,7-9,11,21H,4-6,10H2,(H,24,25)/t11-/m1/s1
InChIKeyONOMJNOWWPXADY-LLVKDONJSA-N
XLogP2.51
TPSA76.37 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.36
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

N-[(2S,4S)-2-methylpiperidin-4-yl]-6-[6-(2,2,2-trifluoroethoxy)imidazo[1,2-a]pyrazin-3-yl]pyridin-2-amine
CID 164561124
N-pyrrolidin-3-yl-6-[7-(2,2,2-trifluoroethoxy)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine
CID 166961993
6-[6-(2,2,2-trifluoroethoxy)imidazo[1,2-a]pyrazin-3-yl]-N-[4-(trifluoromethyl)pyrrolidin-3-yl]pyridin-2-amine
CID 170646369
N-[6-[6-(2,2,2-trifluoroethoxy)imidazo[1,2-a]pyrazin-3-yl]-2-pyridinyl]-5-azaspiro[2.4]heptan-7-amine
CID 170646416
6-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]-N-pyrrolidin-3-ylpyridin-2-amine
CID 164560910
N-[(3R)-piperidin-3-yl]-6-(6-propan-2-yloxyimidazo[1,2-a]pyrazin-3-yl)pyridin-2-amine
CID 164561154
N-pyrrolidin-3-yl-6-[6-(trifluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyridin-2-amine
CID 164537288
1-[3-[6-(pyrrolidin-3-ylamino)-2-pyridinyl]imidazo[1,2-a]pyrazin-6-yl]pyrrolidin-2-one
CID 164560997
6-[6-(3,3-difluoropyrrolidin-1-yl)imidazo[1,2-a]pyrazin-3-yl]-N-pyrrolidin-3-ylpyridin-2-amine
CID 164561142
2-[7-methoxy-3-[6-(pyrrolidin-3-ylamino)-2-pyridinyl]imidazo[1,2-a]pyridin-6-yl]propan-2-ol
CID 166961740
6-[6-cyclopropyl-7-(2,2,2-trifluoroethoxy)imidazo[1,2-a]pyridin-3-yl]-N-[(3R,4S)-4-(trifluoromethyl)pyrrolidin-3-yl]pyridin-2-amine
CID 166961625
6-(6-cyclopropylimidazo[1,2-b]pyridazin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine;difluoromethane
CID 164537196

Frequently Asked Questions

What is the IUPAC name of N-[(3R)-pyrrolidin-3-yl]-6-[6-(2,2,2-trifluoroethoxy)imidazo[1,2-a]pyrazin-3-yl]pyridin-2-amine?
The IUPAC name of N-[(3R)-pyrrolidin-3-yl]-6-[6-(2,2,2-trifluoroethoxy)imidazo[1,2-a]pyrazin-3-yl]pyridin-2-amine (CID 164560903) is N-[(3R)-pyrrolidin-3-yl]-6-[6-(2,2,2-trifluoroethoxy)imidazo[1,2-a]pyrazin-3-yl]pyridin-2-amine.
What is the SMILES notation for N-[(3R)-pyrrolidin-3-yl]-6-[6-(2,2,2-trifluoroethoxy)imidazo[1,2-a]pyrazin-3-yl]pyridin-2-amine?
The canonical SMILES for N-[(3R)-pyrrolidin-3-yl]-6-[6-(2,2,2-trifluoroethoxy)imidazo[1,2-a]pyrazin-3-yl]pyridin-2-amine is FC(F)(F)COc1cn2c(-c3cccc(N[C@@H]4CCNC4)n3)cnc2cn1.
What is the InChIKey of N-[(3R)-pyrrolidin-3-yl]-6-[6-(2,2,2-trifluoroethoxy)imidazo[1,2-a]pyrazin-3-yl]pyridin-2-amine?
The InChIKey is ONOMJNOWWPXADY-LLVKDONJSA-N. The full InChI is InChI=1S/C17H17F3N6O/c18-17(19,20)10-27-16-9-26-13(7-22-15(26)8-23-16)12-2-1-3-14(25-12)24-11-4-5-21-6-11/h1-3,7-9,11,21H,4-6,10H2,(H,24,25)/t11-/m1/s1.
What are the key properties of N-[(3R)-pyrrolidin-3-yl]-6-[6-(2,2,2-trifluoroethoxy)imidazo[1,2-a]pyrazin-3-yl]pyridin-2-amine?
N-[(3R)-pyrrolidin-3-yl]-6-[6-(2,2,2-trifluoroethoxy)imidazo[1,2-a]pyrazin-3-yl]pyridin-2-amine has a molecular weight of 378.36 g/mol, XLogP of 2.51, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3R)-pyrrolidin-3-yl]-6-[6-(2,2,2-trifluoroethoxy)imidazo[1,2-a]pyrazin-3-yl]pyridin-2-amine is sourced from PubChem (CID 164560903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).