[4-(pyridin-2-ylamino)piperidin-1-yl]-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)methanone

C17H22N6O — CID 56895447

IUPAC[4-(pyridin-2-ylamino)piperidin-1-yl]-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)methanone
SMILESO=C(c1cn2c(n1)CNCC2)N1CCC(Nc2ccccn2)CC1
InChIInChI=1S/C17H22N6O/c24-17(14-12-23-10-7-18-11-16(23)21-14)22-8-4-13(5-9-22)20-15-3-1-2-6-19-15/h1-3,6,12-13,18H,4-5,7-11H2,(H,19,20)
InChIKeyRBJFTUVLSHBTPP-UHFFFAOYSA-N
MW326.40 g/mol
LogP1.10
Rot. Bonds3

About [4-(pyridin-2-ylamino)piperidin-1-yl]-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)methanone

[4-(pyridin-2-ylamino)piperidin-1-yl]-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)methanone (PubChem CID 56895447) has the molecular formula C17H22N6O and a molecular weight of 326.40 g/mol. Its IUPAC name is [4-(pyridin-2-ylamino)piperidin-1-yl]-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)methanone.

Molecular Properties

Compound Name[4-(pyridin-2-ylamino)piperidin-1-yl]-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)methanone
PubChem CID56895447
Molecular FormulaC17H22N6O
Molecular Weight326.40 g/mol
Exact Mass326.19
IUPAC Name[4-(pyridin-2-ylamino)piperidin-1-yl]-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)methanone
SMILESO=C(c1cn2c(n1)CNCC2)N1CCC(Nc2ccccn2)CC1
InChIInChI=1S/C17H22N6O/c24-17(14-12-23-10-7-18-11-16(23)21-14)22-8-4-13(5-9-22)20-15-3-1-2-6-19-15/h1-3,6,12-13,18H,4-5,7-11H2,(H,19,20)
InChIKeyRBJFTUVLSHBTPP-UHFFFAOYSA-N
XLogP1.10
TPSA75.08 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [4-(pyridin-2-ylamino)piperidin-1-yl]-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)methanone?
The IUPAC name of [4-(pyridin-2-ylamino)piperidin-1-yl]-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)methanone (CID 56895447) is [4-(pyridin-2-ylamino)piperidin-1-yl]-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)methanone.
What is the SMILES notation for [4-(pyridin-2-ylamino)piperidin-1-yl]-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)methanone?
The canonical SMILES for [4-(pyridin-2-ylamino)piperidin-1-yl]-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)methanone is O=C(c1cn2c(n1)CNCC2)N1CCC(Nc2ccccn2)CC1.
What is the InChIKey of [4-(pyridin-2-ylamino)piperidin-1-yl]-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)methanone?
The InChIKey is RBJFTUVLSHBTPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N6O/c24-17(14-12-23-10-7-18-11-16(23)21-14)22-8-4-13(5-9-22)20-15-3-1-2-6-19-15/h1-3,6,12-13,18H,4-5,7-11H2,(H,19,20).
What are the key properties of [4-(pyridin-2-ylamino)piperidin-1-yl]-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)methanone?
[4-(pyridin-2-ylamino)piperidin-1-yl]-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)methanone has a molecular weight of 326.40 g/mol, XLogP of 1.10, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(pyridin-2-ylamino)piperidin-1-yl]-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)methanone is sourced from PubChem (CID 56895447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).