2,5-dimethyl-N-(6-morpholin-4-yl-3-pyridinyl)thiophene-3-carboxamide

C16H19N3O2S — CID 18158652

IUPAC2,5-dimethyl-N-(6-morpholin-4-yl-3-pyridinyl)thiophene-3-carboxamide
SMILESCc1cc(C(=O)Nc2ccc(N3CCOCC3)nc2)c(C)s1
InChIInChI=1S/C16H19N3O2S/c1-11-9-14(12(2)22-11)16(20)18-13-3-4-15(17-10-13)19-5-7-21-8-6-19/h3-4,9-10H,5-8H2,1-2H3,(H,18,20)
InChIKeyYTZAVTSNTMZTNJ-UHFFFAOYSA-N
MW317.41 g/mol
LogP2.85
Rot. Bonds3

About 2,5-dimethyl-N-(6-morpholin-4-yl-3-pyridinyl)thiophene-3-carboxamide

2,5-dimethyl-N-(6-morpholin-4-yl-3-pyridinyl)thiophene-3-carboxamide (PubChem CID 18158652) has the molecular formula C16H19N3O2S and a molecular weight of 317.41 g/mol. Its IUPAC name is 2,5-dimethyl-N-(6-morpholin-4-yl-3-pyridinyl)thiophene-3-carboxamide.

Molecular Properties

Compound Name2,5-dimethyl-N-(6-morpholin-4-yl-3-pyridinyl)thiophene-3-carboxamide
PubChem CID18158652
Molecular FormulaC16H19N3O2S
Molecular Weight317.41 g/mol
Exact Mass317.12
IUPAC Name2,5-dimethyl-N-(6-morpholin-4-yl-3-pyridinyl)thiophene-3-carboxamide
SMILESCc1cc(C(=O)Nc2ccc(N3CCOCC3)nc2)c(C)s1
InChIInChI=1S/C16H19N3O2S/c1-11-9-14(12(2)22-11)16(20)18-13-3-4-15(17-10-13)19-5-7-21-8-6-19/h3-4,9-10H,5-8H2,1-2H3,(H,18,20)
InChIKeyYTZAVTSNTMZTNJ-UHFFFAOYSA-N
XLogP2.85
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.41
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2,5-dimethyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]thiophene-3-carboxamide
CID 37274285
2-methyl-N-(6-morpholin-4-yl-3-pyridinyl)quinoline-3-carboxamide
CID 86915804
2-amino-N-(6-morpholin-4-yl-3-pyridinyl)benzamide
CID 119946355
5-bromo-2-chloro-N-(6-morpholin-4-yl-3-pyridinyl)benzamide
CID 34442516
N-(3,4-dimethylphenyl)-6-morpholin-4-ylpyridine-3-carboxamide
CID 17424831
1-methyl-3-(6-morpholin-4-yl-3-pyridinyl)urea
CID 47162241
1-benzyl-2,5-dimethyl-N-(6-morpholin-4-yl-3-pyridinyl)pyrrole-3-carboxamide
CID 30771595
2-(2,4-dimethylphenyl)sulfanyl-N-(6-morpholin-4-yl-3-pyridinyl)pyridine-3-carboxamide
CID 32625665
2,2-dimethyl-N-(6-morpholin-4-yl-3-pyridinyl)propanamide
CID 11391397
N-(6-morpholin-4-yl-3-pyridinyl)naphthalene-2-carboxamide
CID 3975213
3,4,5-trichloro-N-(6-morpholin-4-yl-3-pyridinyl)pyridine-2-carboxamide
CID 43038049
2-(4-fluorobenzoyl)-N-(6-morpholin-4-yl-3-pyridinyl)benzamide
CID 46553100

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-N-(6-morpholin-4-yl-3-pyridinyl)thiophene-3-carboxamide?
The IUPAC name of 2,5-dimethyl-N-(6-morpholin-4-yl-3-pyridinyl)thiophene-3-carboxamide (CID 18158652) is 2,5-dimethyl-N-(6-morpholin-4-yl-3-pyridinyl)thiophene-3-carboxamide.
What is the SMILES notation for 2,5-dimethyl-N-(6-morpholin-4-yl-3-pyridinyl)thiophene-3-carboxamide?
The canonical SMILES for 2,5-dimethyl-N-(6-morpholin-4-yl-3-pyridinyl)thiophene-3-carboxamide is Cc1cc(C(=O)Nc2ccc(N3CCOCC3)nc2)c(C)s1.
What is the InChIKey of 2,5-dimethyl-N-(6-morpholin-4-yl-3-pyridinyl)thiophene-3-carboxamide?
The InChIKey is YTZAVTSNTMZTNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2S/c1-11-9-14(12(2)22-11)16(20)18-13-3-4-15(17-10-13)19-5-7-21-8-6-19/h3-4,9-10H,5-8H2,1-2H3,(H,18,20).
What are the key properties of 2,5-dimethyl-N-(6-morpholin-4-yl-3-pyridinyl)thiophene-3-carboxamide?
2,5-dimethyl-N-(6-morpholin-4-yl-3-pyridinyl)thiophene-3-carboxamide has a molecular weight of 317.41 g/mol, XLogP of 2.85, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-N-(6-morpholin-4-yl-3-pyridinyl)thiophene-3-carboxamide is sourced from PubChem (CID 18158652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).