3,5-dichloro-N-propyl-6-(2-thiophen-2-ylethoxy)pyridin-2-amine

C14H16Cl2N2OS — CID 102760896

IUPAC3,5-dichloro-N-propyl-6-(2-thiophen-2-ylethoxy)pyridin-2-amine
SMILESCCCNc1nc(OCCc2cccs2)c(Cl)cc1Cl
InChIInChI=1S/C14H16Cl2N2OS/c1-2-6-17-13-11(15)9-12(16)14(18-13)19-7-5-10-4-3-8-20-10/h3-4,8-9H,2,5-7H2,1H3,(H,17,18)
InChIKeyYYXIRRUPPNNCKQ-UHFFFAOYSA-N
MW331.27 g/mol
LogP4.89
Rot. Bonds7

About 3,5-dichloro-N-propyl-6-(2-thiophen-2-ylethoxy)pyridin-2-amine

3,5-dichloro-N-propyl-6-(2-thiophen-2-ylethoxy)pyridin-2-amine (PubChem CID 102760896) has the molecular formula C14H16Cl2N2OS and a molecular weight of 331.27 g/mol. Its IUPAC name is 3,5-dichloro-N-propyl-6-(2-thiophen-2-ylethoxy)pyridin-2-amine.

Molecular Properties

Compound Name3,5-dichloro-N-propyl-6-(2-thiophen-2-ylethoxy)pyridin-2-amine
PubChem CID102760896
Molecular FormulaC14H16Cl2N2OS
Molecular Weight331.27 g/mol
Exact Mass330.04
IUPAC Name3,5-dichloro-N-propyl-6-(2-thiophen-2-ylethoxy)pyridin-2-amine
SMILESCCCNc1nc(OCCc2cccs2)c(Cl)cc1Cl
InChIInChI=1S/C14H16Cl2N2OS/c1-2-6-17-13-11(15)9-12(16)14(18-13)19-7-5-10-4-3-8-20-10/h3-4,8-9H,2,5-7H2,1H3,(H,17,18)
InChIKeyYYXIRRUPPNNCKQ-UHFFFAOYSA-N
XLogP4.89
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.27
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3,5-dichloro-2-N-propyl-6-N-(thiophen-2-ylmethyl)pyridine-2,6-diamine
CID 102755816
3,5-dichloro-6-[3-(dimethylamino)propoxy]-N-propylpyridin-2-amine
CID 102760859
5-fluoro-N-propyl-4-(2-thiophen-2-ylethoxy)pyrimidin-2-amine
CID 80872490
3,5-dichloro-6-(2-cyclopropylethoxy)-N-propylpyridin-2-amine
CID 106207557
3,5-dichloro-6-[3-(2-methoxyethoxy)propoxy]-N-propylpyridin-2-amine
CID 103408318
[3,5-dichloro-6-(thiophen-2-ylmethoxy)-2-pyridinyl]hydrazine
CID 102762979
3,5-dichloro-6-[(4-chlorophenyl)methoxy]-N-propylpyridin-2-amine
CID 102761015
6-N-propyl-4-N-(2-thiophen-2-ylethyl)pyrimidine-4,6-diamine
CID 80778240
N-[[5-chloro-6-(2-thiophen-2-ylethoxy)-3-pyridinyl]methyl]ethanamine
CID 62323331
3,5-dichloro-6-(2-methylpentoxy)-N-propylpyridin-2-amine
CID 103286396
2-chloro-5-methyl-N-(2-thiophen-2-ylethyl)pyrimidin-4-amine
CID 79075871
3,5-dichloro-6-(5-fluoro-2-methylphenoxy)-N-propylpyridin-2-amine
CID 102989029

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-N-propyl-6-(2-thiophen-2-ylethoxy)pyridin-2-amine?
The IUPAC name of 3,5-dichloro-N-propyl-6-(2-thiophen-2-ylethoxy)pyridin-2-amine (CID 102760896) is 3,5-dichloro-N-propyl-6-(2-thiophen-2-ylethoxy)pyridin-2-amine.
What is the SMILES notation for 3,5-dichloro-N-propyl-6-(2-thiophen-2-ylethoxy)pyridin-2-amine?
The canonical SMILES for 3,5-dichloro-N-propyl-6-(2-thiophen-2-ylethoxy)pyridin-2-amine is CCCNc1nc(OCCc2cccs2)c(Cl)cc1Cl.
What is the InChIKey of 3,5-dichloro-N-propyl-6-(2-thiophen-2-ylethoxy)pyridin-2-amine?
The InChIKey is YYXIRRUPPNNCKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16Cl2N2OS/c1-2-6-17-13-11(15)9-12(16)14(18-13)19-7-5-10-4-3-8-20-10/h3-4,8-9H,2,5-7H2,1H3,(H,17,18).
What are the key properties of 3,5-dichloro-N-propyl-6-(2-thiophen-2-ylethoxy)pyridin-2-amine?
3,5-dichloro-N-propyl-6-(2-thiophen-2-ylethoxy)pyridin-2-amine has a molecular weight of 331.27 g/mol, XLogP of 4.89, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-N-propyl-6-(2-thiophen-2-ylethoxy)pyridin-2-amine is sourced from PubChem (CID 102760896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).