N-[(7-cyclopropylsulfonyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)methyl]pyridin-2-amine

C15H19N5O2S — CID 97467665

IUPACN-[(7-cyclopropylsulfonyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)methyl]pyridin-2-amine
SMILESO=S(=O)(C1CC1)N1CCn2cc(CNc3ccccn3)nc2C1
InChIInChI=1S/C15H19N5O2S/c21-23(22,13-4-5-13)20-8-7-19-10-12(18-15(19)11-20)9-17-14-3-1-2-6-16-14/h1-3,6,10,13H,4-5,7-9,11H2,(H,16,17)
InChIKeyAVYJWBFFEOFWGM-UHFFFAOYSA-N
MW333.42 g/mol
LogP1.20
Rot. Bonds5

About N-[(7-cyclopropylsulfonyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)methyl]pyridin-2-amine

N-[(7-cyclopropylsulfonyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)methyl]pyridin-2-amine (PubChem CID 97467665) has the molecular formula C15H19N5O2S and a molecular weight of 333.42 g/mol. Its IUPAC name is N-[(7-cyclopropylsulfonyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)methyl]pyridin-2-amine.

Molecular Properties

Compound NameN-[(7-cyclopropylsulfonyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)methyl]pyridin-2-amine
PubChem CID97467665
Molecular FormulaC15H19N5O2S
Molecular Weight333.42 g/mol
Exact Mass333.13
IUPAC NameN-[(7-cyclopropylsulfonyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)methyl]pyridin-2-amine
SMILESO=S(=O)(C1CC1)N1CCn2cc(CNc3ccccn3)nc2C1
InChIInChI=1S/C15H19N5O2S/c21-23(22,13-4-5-13)20-8-7-19-10-12(18-15(19)11-20)9-17-14-3-1-2-6-16-14/h1-3,6,10,13H,4-5,7-9,11H2,(H,16,17)
InChIKeyAVYJWBFFEOFWGM-UHFFFAOYSA-N
XLogP1.20
TPSA80.12 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.42
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[(7-cyclopropylsulfonyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)methyl]pyridin-2-amine?
The IUPAC name of N-[(7-cyclopropylsulfonyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)methyl]pyridin-2-amine (CID 97467665) is N-[(7-cyclopropylsulfonyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)methyl]pyridin-2-amine.
What is the SMILES notation for N-[(7-cyclopropylsulfonyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)methyl]pyridin-2-amine?
The canonical SMILES for N-[(7-cyclopropylsulfonyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)methyl]pyridin-2-amine is O=S(=O)(C1CC1)N1CCn2cc(CNc3ccccn3)nc2C1.
What is the InChIKey of N-[(7-cyclopropylsulfonyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)methyl]pyridin-2-amine?
The InChIKey is AVYJWBFFEOFWGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O2S/c21-23(22,13-4-5-13)20-8-7-19-10-12(18-15(19)11-20)9-17-14-3-1-2-6-16-14/h1-3,6,10,13H,4-5,7-9,11H2,(H,16,17).
What are the key properties of N-[(7-cyclopropylsulfonyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)methyl]pyridin-2-amine?
N-[(7-cyclopropylsulfonyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)methyl]pyridin-2-amine has a molecular weight of 333.42 g/mol, XLogP of 1.20, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(7-cyclopropylsulfonyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)methyl]pyridin-2-amine is sourced from PubChem (CID 97467665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).