6-amino-N-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]pyridine-3-carboxamide

C16H15N5OS — CID 91765071

IUPAC6-amino-N-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]pyridine-3-carboxamide
SMILESNc1ccc(C(=O)NCCc2csc(-c3cccnc3)n2)cn1
InChIInChI=1S/C16H15N5OS/c17-14-4-3-11(9-20-14)15(22)19-7-5-13-10-23-16(21-13)12-2-1-6-18-8-12/h1-4,6,8-10H,5,7H2,(H2,17,20)(H,19,22)
InChIKeyFBHASKORMXHLCZ-UHFFFAOYSA-N
MW325.40 g/mol
LogP2.15
Rot. Bonds5

About 6-amino-N-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]pyridine-3-carboxamide

6-amino-N-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]pyridine-3-carboxamide (PubChem CID 91765071) has the molecular formula C16H15N5OS and a molecular weight of 325.40 g/mol. Its IUPAC name is 6-amino-N-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-amino-N-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]pyridine-3-carboxamide
PubChem CID91765071
Molecular FormulaC16H15N5OS
Molecular Weight325.40 g/mol
Exact Mass325.10
IUPAC Name6-amino-N-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]pyridine-3-carboxamide
SMILESNc1ccc(C(=O)NCCc2csc(-c3cccnc3)n2)cn1
InChIInChI=1S/C16H15N5OS/c17-14-4-3-11(9-20-14)15(22)19-7-5-13-10-23-16(21-13)12-2-1-6-18-8-12/h1-4,6,8-10H,5,7H2,(H2,17,20)(H,19,22)
InChIKeyFBHASKORMXHLCZ-UHFFFAOYSA-N
XLogP2.15
TPSA93.79 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.40
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

6-oxo-N-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]-1H-pyridine-3-carboxamide
CID 110624969
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N-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]-3-pyrrol-1-ylbenzamide
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3-methyl-4-nitro-N-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]benzamide
CID 7163672
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CID 91789629
2-(4-methoxyphenyl)-N-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]acetamide
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3-phenoxy-N-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]propanamide
CID 112500659
3-(2-pyridin-3-yl-1,3-thiazol-4-yl)-N-[2-(1,3-thiazol-4-yl)ethyl]propanamide
CID 110624792
2-(4-methylphenoxy)-N-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]acetamide
CID 110285011
4-(4-methoxyphenyl)-4-oxo-N-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]butanamide
CID 110624951
N-[(2-phenyl-1,3-thiazol-4-yl)methyl]pyridine-3-carboxamide
CID 17164666

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]pyridine-3-carboxamide?
The IUPAC name of 6-amino-N-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]pyridine-3-carboxamide (CID 91765071) is 6-amino-N-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-amino-N-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]pyridine-3-carboxamide?
The canonical SMILES for 6-amino-N-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]pyridine-3-carboxamide is Nc1ccc(C(=O)NCCc2csc(-c3cccnc3)n2)cn1.
What is the InChIKey of 6-amino-N-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]pyridine-3-carboxamide?
The InChIKey is FBHASKORMXHLCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N5OS/c17-14-4-3-11(9-20-14)15(22)19-7-5-13-10-23-16(21-13)12-2-1-6-18-8-12/h1-4,6,8-10H,5,7H2,(H2,17,20)(H,19,22).
What are the key properties of 6-amino-N-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]pyridine-3-carboxamide?
6-amino-N-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]pyridine-3-carboxamide has a molecular weight of 325.40 g/mol, XLogP of 2.15, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]pyridine-3-carboxamide is sourced from PubChem (CID 91765071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).