3-N-propyl-5-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3,5-diamine

C15H21N3S — CID 104533484

IUPAC3-N-propyl-5-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3,5-diamine
SMILESCCCNc1cncc(NC(C)Cc2ccsc2)c1
InChIInChI=1S/C15H21N3S/c1-3-5-17-14-8-15(10-16-9-14)18-12(2)7-13-4-6-19-11-13/h4,6,8-12,17-18H,3,5,7H2,1-2H3
InChIKeyQYXJYZSWYSLNAZ-UHFFFAOYSA-N
MW275.42 g/mol
LogP4.01
Rot. Bonds7

About 3-N-propyl-5-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3,5-diamine

3-N-propyl-5-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3,5-diamine (PubChem CID 104533484) has the molecular formula C15H21N3S and a molecular weight of 275.42 g/mol. Its IUPAC name is 3-N-propyl-5-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3,5-diamine.

Molecular Properties

Compound Name3-N-propyl-5-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3,5-diamine
PubChem CID104533484
Molecular FormulaC15H21N3S
Molecular Weight275.42 g/mol
Exact Mass275.15
IUPAC Name3-N-propyl-5-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3,5-diamine
SMILESCCCNc1cncc(NC(C)Cc2ccsc2)c1
InChIInChI=1S/C15H21N3S/c1-3-5-17-14-8-15(10-16-9-14)18-12(2)7-13-4-6-19-11-13/h4,6,8-12,17-18H,3,5,7H2,1-2H3
InChIKeyQYXJYZSWYSLNAZ-UHFFFAOYSA-N
XLogP4.01
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.42
LogP ≤ 54.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-methyl-N-(1-thiophen-3-ylpropan-2-yl)pyridin-3-amine
CID 115921558
5-N-pentan-3-yl-3-N-propylpyridine-3,5-diamine
CID 104532563
5-N-(1-cyclopropylpropan-2-yl)-3-N-propylpyridine-3,5-diamine
CID 104534762
N-[1-(5-propan-2-yloxy-3-pyridinyl)-2-thiophen-3-ylethyl]propan-1-amine
CID 105176149
5-N-(1-methoxy-3-methylbutan-2-yl)-3-N-propylpyridine-3,5-diamine
CID 113424095
5-N-(1-cyclopropylethyl)-3-N-propylpyridine-3,5-diamine
CID 104532953
5-fluoro-N-(1-thiophen-3-ylpropan-2-yl)pyridin-2-amine
CID 61474267
N-(2-fluoroethyl)-1-thiophen-3-ylpropan-2-amine
CID 80694035
1-propyl-3-(1-thiophen-3-ylpropan-2-yl)thiourea
CID 115590115
5-ethoxy-3-N-(1-thiophen-3-ylpropan-2-yl)benzene-1,3-diamine
CID 80739473
N-(2-methylpropyl)-2-[[5-(propylamino)-3-pyridinyl]amino]propanamide
CID 104535813
3-N-propyl-5-N-(pyridin-4-ylmethyl)pyridine-3,5-diamine
CID 104532744

Frequently Asked Questions

What is the IUPAC name of 3-N-propyl-5-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3,5-diamine?
The IUPAC name of 3-N-propyl-5-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3,5-diamine (CID 104533484) is 3-N-propyl-5-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3,5-diamine.
What is the SMILES notation for 3-N-propyl-5-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3,5-diamine?
The canonical SMILES for 3-N-propyl-5-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3,5-diamine is CCCNc1cncc(NC(C)Cc2ccsc2)c1.
What is the InChIKey of 3-N-propyl-5-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3,5-diamine?
The InChIKey is QYXJYZSWYSLNAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3S/c1-3-5-17-14-8-15(10-16-9-14)18-12(2)7-13-4-6-19-11-13/h4,6,8-12,17-18H,3,5,7H2,1-2H3.
What are the key properties of 3-N-propyl-5-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3,5-diamine?
3-N-propyl-5-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3,5-diamine has a molecular weight of 275.42 g/mol, XLogP of 4.01, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-propyl-5-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3,5-diamine is sourced from PubChem (CID 104533484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).