5-(2-aminopropyl)-N-methyl-N-(1-thiophen-2-ylpropan-2-yl)pyridin-2-amine

C16H23N3S — CID 80634325

IUPAC5-(2-aminopropyl)-N-methyl-N-(1-thiophen-2-ylpropan-2-yl)pyridin-2-amine
SMILESCC(N)Cc1ccc(N(C)C(C)Cc2cccs2)nc1
InChIInChI=1S/C16H23N3S/c1-12(17)9-14-6-7-16(18-11-14)19(3)13(2)10-15-5-4-8-20-15/h4-8,11-13H,9-10,17H2,1-3H3
InChIKeyHWNFRXJIFLATLU-UHFFFAOYSA-N
MW289.45 g/mol
LogP3.10
Rot. Bonds6

About 5-(2-aminopropyl)-N-methyl-N-(1-thiophen-2-ylpropan-2-yl)pyridin-2-amine

5-(2-aminopropyl)-N-methyl-N-(1-thiophen-2-ylpropan-2-yl)pyridin-2-amine (PubChem CID 80634325) has the molecular formula C16H23N3S and a molecular weight of 289.45 g/mol. Its IUPAC name is 5-(2-aminopropyl)-N-methyl-N-(1-thiophen-2-ylpropan-2-yl)pyridin-2-amine.

Molecular Properties

Compound Name5-(2-aminopropyl)-N-methyl-N-(1-thiophen-2-ylpropan-2-yl)pyridin-2-amine
PubChem CID80634325
Molecular FormulaC16H23N3S
Molecular Weight289.45 g/mol
Exact Mass289.16
IUPAC Name5-(2-aminopropyl)-N-methyl-N-(1-thiophen-2-ylpropan-2-yl)pyridin-2-amine
SMILESCC(N)Cc1ccc(N(C)C(C)Cc2cccs2)nc1
InChIInChI=1S/C16H23N3S/c1-12(17)9-14-6-7-16(18-11-14)19(3)13(2)10-15-5-4-8-20-15/h4-8,11-13H,9-10,17H2,1-3H3
InChIKeyHWNFRXJIFLATLU-UHFFFAOYSA-N
XLogP3.10
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.45
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(2-aminopropyl)-N-propan-2-yl-N-(thiophen-2-ylmethyl)pyridin-2-amine
CID 80634233
5-(2-aminopropyl)-N-butan-2-yl-N-methylpyridin-2-amine
CID 80633292
3-N-methyl-3-N-(1-thiophen-2-ylpropan-2-yl)pyrazine-2,3-diamine
CID 113268505
5-(2-aminopropyl)-N-benzyl-N-ethylpyridin-2-amine
CID 80633726
1-[5-[methyl(1-thiophen-2-ylpropan-2-yl)amino]-2-pyridinyl]propan-1-ol
CID 115940490
5-[(cyclopropylamino)methyl]-N-methyl-N-(1-thiophen-2-ylpropan-2-yl)pyrazin-2-amine
CID 107380520
5-N-methyl-5-N-(1-thiophen-2-ylpropan-2-yl)pyridine-3,5-diamine
CID 104535249
N-methyl-6-[1-(methylamino)ethyl]-N-(1-thiophen-2-ylpropan-2-yl)pyridin-3-amine
CID 83127076
N-methyl-6-(propylaminomethyl)-N-(1-thiophen-2-ylpropan-2-yl)pyridin-2-amine
CID 79490150
5-(2-aminobutyl)-N-methyl-N-propan-2-ylpyridin-2-amine
CID 80632913
5-(2-aminopropyl)-N-methyl-N-pentylpyridin-2-amine
CID 80633509
N-methyl-5-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]pyridin-2-amine
CID 79486431

Frequently Asked Questions

What is the IUPAC name of 5-(2-aminopropyl)-N-methyl-N-(1-thiophen-2-ylpropan-2-yl)pyridin-2-amine?
The IUPAC name of 5-(2-aminopropyl)-N-methyl-N-(1-thiophen-2-ylpropan-2-yl)pyridin-2-amine (CID 80634325) is 5-(2-aminopropyl)-N-methyl-N-(1-thiophen-2-ylpropan-2-yl)pyridin-2-amine.
What is the SMILES notation for 5-(2-aminopropyl)-N-methyl-N-(1-thiophen-2-ylpropan-2-yl)pyridin-2-amine?
The canonical SMILES for 5-(2-aminopropyl)-N-methyl-N-(1-thiophen-2-ylpropan-2-yl)pyridin-2-amine is CC(N)Cc1ccc(N(C)C(C)Cc2cccs2)nc1.
What is the InChIKey of 5-(2-aminopropyl)-N-methyl-N-(1-thiophen-2-ylpropan-2-yl)pyridin-2-amine?
The InChIKey is HWNFRXJIFLATLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3S/c1-12(17)9-14-6-7-16(18-11-14)19(3)13(2)10-15-5-4-8-20-15/h4-8,11-13H,9-10,17H2,1-3H3.
What are the key properties of 5-(2-aminopropyl)-N-methyl-N-(1-thiophen-2-ylpropan-2-yl)pyridin-2-amine?
5-(2-aminopropyl)-N-methyl-N-(1-thiophen-2-ylpropan-2-yl)pyridin-2-amine has a molecular weight of 289.45 g/mol, XLogP of 3.10, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-aminopropyl)-N-methyl-N-(1-thiophen-2-ylpropan-2-yl)pyridin-2-amine is sourced from PubChem (CID 80634325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).