4-amino-2-piperidin-1-yl-N-pyridin-3-yl-1,3-thiazole-5-carboxamide

C14H17N5OS — CID 116667887

IUPAC4-amino-2-piperidin-1-yl-N-pyridin-3-yl-1,3-thiazole-5-carboxamide
SMILESNc1nc(N2CCCCC2)sc1C(=O)Nc1cccnc1
InChIInChI=1S/C14H17N5OS/c15-12-11(13(20)17-10-5-4-6-16-9-10)21-14(18-12)19-7-2-1-3-8-19/h4-6,9H,1-3,7-8,15H2,(H,17,20)
InChIKeyHHRTVRCYGIFQKQ-UHFFFAOYSA-N
MW303.39 g/mol
LogP2.36
Rot. Bonds3

About 4-amino-2-piperidin-1-yl-N-pyridin-3-yl-1,3-thiazole-5-carboxamide

4-amino-2-piperidin-1-yl-N-pyridin-3-yl-1,3-thiazole-5-carboxamide (PubChem CID 116667887) has the molecular formula C14H17N5OS and a molecular weight of 303.39 g/mol. Its IUPAC name is 4-amino-2-piperidin-1-yl-N-pyridin-3-yl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name4-amino-2-piperidin-1-yl-N-pyridin-3-yl-1,3-thiazole-5-carboxamide
PubChem CID116667887
Molecular FormulaC14H17N5OS
Molecular Weight303.39 g/mol
Exact Mass303.12
IUPAC Name4-amino-2-piperidin-1-yl-N-pyridin-3-yl-1,3-thiazole-5-carboxamide
SMILESNc1nc(N2CCCCC2)sc1C(=O)Nc1cccnc1
InChIInChI=1S/C14H17N5OS/c15-12-11(13(20)17-10-5-4-6-16-9-10)21-14(18-12)19-7-2-1-3-8-19/h4-6,9H,1-3,7-8,15H2,(H,17,20)
InChIKeyHHRTVRCYGIFQKQ-UHFFFAOYSA-N
XLogP2.36
TPSA84.14 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.39
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-amino-2-piperidin-1-yl-N-pyridin-3-yl-1,3-thiazole-5-carboxamide?
The IUPAC name of 4-amino-2-piperidin-1-yl-N-pyridin-3-yl-1,3-thiazole-5-carboxamide (CID 116667887) is 4-amino-2-piperidin-1-yl-N-pyridin-3-yl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 4-amino-2-piperidin-1-yl-N-pyridin-3-yl-1,3-thiazole-5-carboxamide?
The canonical SMILES for 4-amino-2-piperidin-1-yl-N-pyridin-3-yl-1,3-thiazole-5-carboxamide is Nc1nc(N2CCCCC2)sc1C(=O)Nc1cccnc1.
What is the InChIKey of 4-amino-2-piperidin-1-yl-N-pyridin-3-yl-1,3-thiazole-5-carboxamide?
The InChIKey is HHRTVRCYGIFQKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5OS/c15-12-11(13(20)17-10-5-4-6-16-9-10)21-14(18-12)19-7-2-1-3-8-19/h4-6,9H,1-3,7-8,15H2,(H,17,20).
What are the key properties of 4-amino-2-piperidin-1-yl-N-pyridin-3-yl-1,3-thiazole-5-carboxamide?
4-amino-2-piperidin-1-yl-N-pyridin-3-yl-1,3-thiazole-5-carboxamide has a molecular weight of 303.39 g/mol, XLogP of 2.36, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2-piperidin-1-yl-N-pyridin-3-yl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 116667887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).