5-bromo-2-(ethylamino)-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-carboxamide

C15H18BrN3OS — CID 62176839

IUPAC5-bromo-2-(ethylamino)-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-carboxamide
SMILESCCNc1ncc(Br)cc1C(=O)NC(C)Cc1ccsc1
InChIInChI=1S/C15H18BrN3OS/c1-3-17-14-13(7-12(16)8-18-14)15(20)19-10(2)6-11-4-5-21-9-11/h4-5,7-10H,3,6H2,1-2H3,(H,17,18)(H,19,20)
InChIKeyOBWCKNWYMYPVCX-UHFFFAOYSA-N
MW368.30 g/mol
LogP3.70
Rot. Bonds6

About 5-bromo-2-(ethylamino)-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-carboxamide

5-bromo-2-(ethylamino)-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-carboxamide (PubChem CID 62176839) has the molecular formula C15H18BrN3OS and a molecular weight of 368.30 g/mol. Its IUPAC name is 5-bromo-2-(ethylamino)-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-bromo-2-(ethylamino)-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-carboxamide
PubChem CID62176839
Molecular FormulaC15H18BrN3OS
Molecular Weight368.30 g/mol
Exact Mass367.04
IUPAC Name5-bromo-2-(ethylamino)-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-carboxamide
SMILESCCNc1ncc(Br)cc1C(=O)NC(C)Cc1ccsc1
InChIInChI=1S/C15H18BrN3OS/c1-3-17-14-13(7-12(16)8-18-14)15(20)19-10(2)6-11-4-5-21-9-11/h4-5,7-10H,3,6H2,1-2H3,(H,17,18)(H,19,20)
InChIKeyOBWCKNWYMYPVCX-UHFFFAOYSA-N
XLogP3.70
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.30
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-N-[1-(dimethylamino)propan-2-yl]-2-(ethylamino)pyridine-3-carboxamide
CID 82949791
5-bromo-2-(ethylamino)-N-(1-thiophen-2-ylethyl)pyridine-3-carboxamide
CID 62169182
5-bromo-N-(4-methylpentan-2-yl)-2-(propylamino)pyridine-3-carboxamide
CID 63499508
4-(ethylamino)-N-(1-thiophen-3-ylpropan-2-yl)benzamide
CID 62177548
2-amino-5-chloro-N-(1-thiophen-3-ylpropan-2-yl)pyridine-4-carboxamide
CID 114923012
5-bromo-3-chloro-N-(1-thiophen-3-ylpropan-2-yl)pyridin-2-amine
CID 103582447
2-amino-5-methyl-N-(1-thiophen-3-ylpropan-2-yl)benzamide
CID 62509065
2-(1-thiophen-3-ylpropan-2-ylcarbamoyl)benzoic acid
CID 61475052
3-fluoro-2-(methylamino)-N-(1-thiophen-3-ylpropan-2-yl)pyridine-4-carboxamide
CID 105385704
5-bromo-2-chloro-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-sulfonamide
CID 61223337
2,4-diamino-N-(1-thiophen-3-ylpropan-2-yl)benzamide
CID 61471843
5-bromo-N-(1-methoxypropan-2-yl)-2-(propylamino)pyridine-3-carboxamide
CID 62186287

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-(ethylamino)-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-carboxamide?
The IUPAC name of 5-bromo-2-(ethylamino)-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-carboxamide (CID 62176839) is 5-bromo-2-(ethylamino)-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-carboxamide.
What is the SMILES notation for 5-bromo-2-(ethylamino)-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-carboxamide?
The canonical SMILES for 5-bromo-2-(ethylamino)-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-carboxamide is CCNc1ncc(Br)cc1C(=O)NC(C)Cc1ccsc1.
What is the InChIKey of 5-bromo-2-(ethylamino)-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-carboxamide?
The InChIKey is OBWCKNWYMYPVCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18BrN3OS/c1-3-17-14-13(7-12(16)8-18-14)15(20)19-10(2)6-11-4-5-21-9-11/h4-5,7-10H,3,6H2,1-2H3,(H,17,18)(H,19,20).
What are the key properties of 5-bromo-2-(ethylamino)-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-carboxamide?
5-bromo-2-(ethylamino)-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-carboxamide has a molecular weight of 368.30 g/mol, XLogP of 3.70, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-(ethylamino)-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-carboxamide is sourced from PubChem (CID 62176839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).