5-amino-N-ethyl-2-(5-methylthiophen-2-yl)-N-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide

C17H21N5OS — CID 23552668

IUPAC5-amino-N-ethyl-2-(5-methylthiophen-2-yl)-N-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide
SMILESCCN(C(=O)c1cc(N)n2nc(-c3ccc(C)s3)nc2c1)C(C)C
InChIInChI=1S/C17H21N5OS/c1-5-21(10(2)3)17(23)12-8-14(18)22-15(9-12)19-16(20-22)13-7-6-11(4)24-13/h6-10H,5,18H2,1-4H3
InChIKeyKHNCWRILNKSKGT-UHFFFAOYSA-N
MW343.46 g/mol
LogP3.22
Rot. Bonds4

About 5-amino-N-ethyl-2-(5-methylthiophen-2-yl)-N-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide

5-amino-N-ethyl-2-(5-methylthiophen-2-yl)-N-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide (PubChem CID 23552668) has the molecular formula C17H21N5OS and a molecular weight of 343.46 g/mol. Its IUPAC name is 5-amino-N-ethyl-2-(5-methylthiophen-2-yl)-N-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide.

Molecular Properties

Compound Name5-amino-N-ethyl-2-(5-methylthiophen-2-yl)-N-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide
PubChem CID23552668
Molecular FormulaC17H21N5OS
Molecular Weight343.46 g/mol
Exact Mass343.15
IUPAC Name5-amino-N-ethyl-2-(5-methylthiophen-2-yl)-N-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide
SMILESCCN(C(=O)c1cc(N)n2nc(-c3ccc(C)s3)nc2c1)C(C)C
InChIInChI=1S/C17H21N5OS/c1-5-21(10(2)3)17(23)12-8-14(18)22-15(9-12)19-16(20-22)13-7-6-11(4)24-13/h6-10H,5,18H2,1-4H3
InChIKeyKHNCWRILNKSKGT-UHFFFAOYSA-N
XLogP3.22
TPSA76.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.46
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-amino-N-butyl-2-(5-methylthiophen-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide
CID 11393342
2-(5-methylthiophen-2-yl)-7-pyridin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-5-amine
CID 18313657
5-amino-2-(5-chlorofuran-2-yl)-N,N-diethyl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide
CID 23552510
5-amino-N-benzyl-2-(5-chlorofuran-2-yl)-N-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide
CID 23552590
3-bromo-N-ethyl-5-methyl-N-propan-2-ylbenzamide
CID 104851891
5-amino-2-(5-chlorofuran-2-yl)-N,N-dimethyl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide
CID 23552511
3-amino-N-ethyl-N-propan-2-ylbenzamide;hydrochloride
CID 119705659
5-amino-2-(5-bromofuran-2-yl)-N-[2-(diethylamino)ethyl]-N-ethyl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide
CID 23552486
3-amino-4-chloro-N-ethyl-N-propan-2-ylbenzamide
CID 43265294
methyl 2-(5-methylthiophen-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate
CID 117134868
N-ethyl-6-fluoro-N-propan-2-ylpyridine-3-carboxamide
CID 63973149
2-(5-methylthiophen-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-amine
CID 117130233

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-ethyl-2-(5-methylthiophen-2-yl)-N-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide?
The IUPAC name of 5-amino-N-ethyl-2-(5-methylthiophen-2-yl)-N-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide (CID 23552668) is 5-amino-N-ethyl-2-(5-methylthiophen-2-yl)-N-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide.
What is the SMILES notation for 5-amino-N-ethyl-2-(5-methylthiophen-2-yl)-N-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide?
The canonical SMILES for 5-amino-N-ethyl-2-(5-methylthiophen-2-yl)-N-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide is CCN(C(=O)c1cc(N)n2nc(-c3ccc(C)s3)nc2c1)C(C)C.
What is the InChIKey of 5-amino-N-ethyl-2-(5-methylthiophen-2-yl)-N-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide?
The InChIKey is KHNCWRILNKSKGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N5OS/c1-5-21(10(2)3)17(23)12-8-14(18)22-15(9-12)19-16(20-22)13-7-6-11(4)24-13/h6-10H,5,18H2,1-4H3.
What are the key properties of 5-amino-N-ethyl-2-(5-methylthiophen-2-yl)-N-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide?
5-amino-N-ethyl-2-(5-methylthiophen-2-yl)-N-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide has a molecular weight of 343.46 g/mol, XLogP of 3.22, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-ethyl-2-(5-methylthiophen-2-yl)-N-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide is sourced from PubChem (CID 23552668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).