3-(propylamino)-N-(1-thiophen-2-ylethyl)pyridine-4-carboxamide

C15H19N3OS — CID 105068619

IUPAC3-(propylamino)-N-(1-thiophen-2-ylethyl)pyridine-4-carboxamide
SMILESCCCNc1cnccc1C(=O)NC(C)c1cccs1
InChIInChI=1S/C15H19N3OS/c1-3-7-17-13-10-16-8-6-12(13)15(19)18-11(2)14-5-4-9-20-14/h4-6,8-11,17H,3,7H2,1-2H3,(H,18,19)
InChIKeyCPCIZURPVACDHS-UHFFFAOYSA-N
MW289.40 g/mol
LogP3.46
Rot. Bonds6

About 3-(propylamino)-N-(1-thiophen-2-ylethyl)pyridine-4-carboxamide

3-(propylamino)-N-(1-thiophen-2-ylethyl)pyridine-4-carboxamide (PubChem CID 105068619) has the molecular formula C15H19N3OS and a molecular weight of 289.40 g/mol. Its IUPAC name is 3-(propylamino)-N-(1-thiophen-2-ylethyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-(propylamino)-N-(1-thiophen-2-ylethyl)pyridine-4-carboxamide
PubChem CID105068619
Molecular FormulaC15H19N3OS
Molecular Weight289.40 g/mol
Exact Mass289.12
IUPAC Name3-(propylamino)-N-(1-thiophen-2-ylethyl)pyridine-4-carboxamide
SMILESCCCNc1cnccc1C(=O)NC(C)c1cccs1
InChIInChI=1S/C15H19N3OS/c1-3-7-17-13-10-16-8-6-12(13)15(19)18-11(2)14-5-4-9-20-14/h4-6,8-11,17H,3,7H2,1-2H3,(H,18,19)
InChIKeyCPCIZURPVACDHS-UHFFFAOYSA-N
XLogP3.46
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.40
LogP ≤ 53.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(ethylamino)-N-(1-thiophen-2-ylbutyl)pyridine-4-carboxamide
CID 105069176
N-(2-methylpentan-3-yl)-3-(propylamino)pyridine-4-carboxamide
CID 105069100
5-chloro-2-(propylamino)-N-(1-thiophen-2-ylethyl)benzamide
CID 62170551
N-[2-oxo-2-(propan-2-ylamino)ethyl]-3-(propylamino)pyridine-4-carboxamide
CID 105068732
N-[1-(dimethylamino)propan-2-yl]-3-(propylamino)pyridine-4-carboxamide
CID 105070967
N-(4-methylhexan-2-yl)-3-(propylamino)pyridine-4-carboxamide
CID 105070483
N-(1-imidazol-1-ylpropan-2-yl)-3-(propylamino)pyridine-4-carboxamide
CID 105069520
N-(4-methyl-1,3-thiazol-2-yl)-3-(propylamino)pyridine-4-carboxamide
CID 105068083
4-(propylamino)-N-(1-pyridin-2-ylethyl)pyridine-3-carboxamide
CID 81239560
N-(2-propan-2-ylpyrazol-3-yl)-3-(propylamino)pyridine-4-carboxamide
CID 105067928
N-(1-thiophen-2-ylethyl)pyridazine-4-carboxamide
CID 91510473
N-ethyl-N-propan-2-yl-3-(propylamino)pyridine-4-carboxamide
CID 105068541

Frequently Asked Questions

What is the IUPAC name of 3-(propylamino)-N-(1-thiophen-2-ylethyl)pyridine-4-carboxamide?
The IUPAC name of 3-(propylamino)-N-(1-thiophen-2-ylethyl)pyridine-4-carboxamide (CID 105068619) is 3-(propylamino)-N-(1-thiophen-2-ylethyl)pyridine-4-carboxamide.
What is the SMILES notation for 3-(propylamino)-N-(1-thiophen-2-ylethyl)pyridine-4-carboxamide?
The canonical SMILES for 3-(propylamino)-N-(1-thiophen-2-ylethyl)pyridine-4-carboxamide is CCCNc1cnccc1C(=O)NC(C)c1cccs1.
What is the InChIKey of 3-(propylamino)-N-(1-thiophen-2-ylethyl)pyridine-4-carboxamide?
The InChIKey is CPCIZURPVACDHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3OS/c1-3-7-17-13-10-16-8-6-12(13)15(19)18-11(2)14-5-4-9-20-14/h4-6,8-11,17H,3,7H2,1-2H3,(H,18,19).
What are the key properties of 3-(propylamino)-N-(1-thiophen-2-ylethyl)pyridine-4-carboxamide?
3-(propylamino)-N-(1-thiophen-2-ylethyl)pyridine-4-carboxamide has a molecular weight of 289.40 g/mol, XLogP of 3.46, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(propylamino)-N-(1-thiophen-2-ylethyl)pyridine-4-carboxamide is sourced from PubChem (CID 105068619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).