5-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyridine-2-carboxamide

C14H22N4OS — CID 106327192

IUPAC5-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyridine-2-carboxamide
SMILESCCNc1ccc(C(=O)NCCN2CCSCC2)nc1
InChIInChI=1S/C14H22N4OS/c1-2-15-12-3-4-13(17-11-12)14(19)16-5-6-18-7-9-20-10-8-18/h3-4,11,15H,2,5-10H2,1H3,(H,16,19)
InChIKeyCGWKCSWYCAONLO-UHFFFAOYSA-N
MW294.42 g/mol
LogP1.29
Rot. Bonds6

About 5-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyridine-2-carboxamide

5-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyridine-2-carboxamide (PubChem CID 106327192) has the molecular formula C14H22N4OS and a molecular weight of 294.42 g/mol. Its IUPAC name is 5-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyridine-2-carboxamide
PubChem CID106327192
Molecular FormulaC14H22N4OS
Molecular Weight294.42 g/mol
Exact Mass294.15
IUPAC Name5-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyridine-2-carboxamide
SMILESCCNc1ccc(C(=O)NCCN2CCSCC2)nc1
InChIInChI=1S/C14H22N4OS/c1-2-15-12-3-4-13(17-11-12)14(19)16-5-6-18-7-9-20-10-8-18/h3-4,11,15H,2,5-10H2,1H3,(H,16,19)
InChIKeyCGWKCSWYCAONLO-UHFFFAOYSA-N
XLogP1.29
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.42
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyrazine-2-carboxamide
CID 106327146
5-chloro-6-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyridine-3-carboxamide
CID 106327037
4-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyridine-3-carboxamide
CID 106327044
5-chloro-2-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)benzamide
CID 103529940
N-(2-methoxyethyl)-5-(2-morpholin-4-ylethylamino)pyridine-2-carboxamide
CID 109183829
5-(ethylamino)-N-(4-imidazol-1-ylbutyl)pyridine-2-carboxamide
CID 104640721
5-amino-N-[2-(4-methylpiperazin-1-yl)ethyl]pyridine-2-carboxamide
CID 81316862
5-(ethylamino)-N-(1,3-thiazol-4-ylmethyl)pyridine-2-carboxamide
CID 113436186
5-(ethylamino)-N-(5-methylhexyl)pyridine-2-carboxamide
CID 104641912
5-(ethylamino)-N-[2-(4-fluorophenyl)ethyl]pyridine-2-carboxamide
CID 104639698
5-(ethylamino)-N-methylpyridine-2-carboxamide
CID 104639889
5-[2-(4-fluorophenyl)ethylamino]-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
CID 109185666

Frequently Asked Questions

What is the IUPAC name of 5-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyridine-2-carboxamide?
The IUPAC name of 5-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyridine-2-carboxamide (CID 106327192) is 5-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyridine-2-carboxamide?
The canonical SMILES for 5-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyridine-2-carboxamide is CCNc1ccc(C(=O)NCCN2CCSCC2)nc1.
What is the InChIKey of 5-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyridine-2-carboxamide?
The InChIKey is CGWKCSWYCAONLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4OS/c1-2-15-12-3-4-13(17-11-12)14(19)16-5-6-18-7-9-20-10-8-18/h3-4,11,15H,2,5-10H2,1H3,(H,16,19).
What are the key properties of 5-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyridine-2-carboxamide?
5-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyridine-2-carboxamide has a molecular weight of 294.42 g/mol, XLogP of 1.29, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyridine-2-carboxamide is sourced from PubChem (CID 106327192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).