2-methyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine

C16H23N5S — CID 86786497

IUPAC2-methyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine
SMILESCc1cn2c(n1)CCC(NC1CCN(c3nccs3)CC1)C2
InChIInChI=1S/C16H23N5S/c1-12-10-21-11-14(2-3-15(21)18-12)19-13-4-7-20(8-5-13)16-17-6-9-22-16/h6,9-10,13-14,19H,2-5,7-8,11H2,1H3
InChIKeyPDUKSKVBHDWSBL-UHFFFAOYSA-N
MW317.46 g/mol
LogP2.22
Rot. Bonds3

About 2-methyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine

2-methyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine (PubChem CID 86786497) has the molecular formula C16H23N5S and a molecular weight of 317.46 g/mol. Its IUPAC name is 2-methyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine.

Molecular Properties

Compound Name2-methyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine
PubChem CID86786497
Molecular FormulaC16H23N5S
Molecular Weight317.46 g/mol
Exact Mass317.17
IUPAC Name2-methyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine
SMILESCc1cn2c(n1)CCC(NC1CCN(c3nccs3)CC1)C2
InChIInChI=1S/C16H23N5S/c1-12-10-21-11-14(2-3-15(21)18-12)19-13-4-7-20(8-5-13)16-17-6-9-22-16/h6,9-10,13-14,19H,2-5,7-8,11H2,1H3
InChIKeyPDUKSKVBHDWSBL-UHFFFAOYSA-N
XLogP2.22
TPSA45.98 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.46
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine?
The IUPAC name of 2-methyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine (CID 86786497) is 2-methyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine.
What is the SMILES notation for 2-methyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine?
The canonical SMILES for 2-methyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine is Cc1cn2c(n1)CCC(NC1CCN(c3nccs3)CC1)C2.
What is the InChIKey of 2-methyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine?
The InChIKey is PDUKSKVBHDWSBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N5S/c1-12-10-21-11-14(2-3-15(21)18-12)19-13-4-7-20(8-5-13)16-17-6-9-22-16/h6,9-10,13-14,19H,2-5,7-8,11H2,1H3.
What are the key properties of 2-methyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine?
2-methyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine has a molecular weight of 317.46 g/mol, XLogP of 2.22, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine is sourced from PubChem (CID 86786497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).