N-[cyclopentyl(thieno[3,2-b]pyridin-6-yl)methyl]propan-1-amine

C16H22N2S — CID 81144181

IUPACN-[cyclopentyl(thieno[3,2-b]pyridin-6-yl)methyl]propan-1-amine
SMILESCCCNC(c1cnc2ccsc2c1)C1CCCC1
InChIInChI=1S/C16H22N2S/c1-2-8-17-16(12-5-3-4-6-12)13-10-15-14(18-11-13)7-9-19-15/h7,9-12,16-17H,2-6,8H2,1H3
InChIKeyJRHGJBHBFJMAMC-UHFFFAOYSA-N
MW274.43 g/mol
LogP4.53
Rot. Bonds5

About N-[cyclopentyl(thieno[3,2-b]pyridin-6-yl)methyl]propan-1-amine

N-[cyclopentyl(thieno[3,2-b]pyridin-6-yl)methyl]propan-1-amine (PubChem CID 81144181) has the molecular formula C16H22N2S and a molecular weight of 274.43 g/mol. Its IUPAC name is N-[cyclopentyl(thieno[3,2-b]pyridin-6-yl)methyl]propan-1-amine.

Molecular Properties

Compound NameN-[cyclopentyl(thieno[3,2-b]pyridin-6-yl)methyl]propan-1-amine
PubChem CID81144181
Molecular FormulaC16H22N2S
Molecular Weight274.43 g/mol
Exact Mass274.15
IUPAC NameN-[cyclopentyl(thieno[3,2-b]pyridin-6-yl)methyl]propan-1-amine
SMILESCCCNC(c1cnc2ccsc2c1)C1CCCC1
InChIInChI=1S/C16H22N2S/c1-2-8-17-16(12-5-3-4-6-12)13-10-15-14(18-11-13)7-9-19-15/h7,9-12,16-17H,2-6,8H2,1H3
InChIKeyJRHGJBHBFJMAMC-UHFFFAOYSA-N
XLogP4.53
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.43
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[cycloheptyl(thieno[3,2-b]pyridin-6-yl)methyl]ethanamine
CID 82931928
[cyclopentyl(thieno[3,2-b]pyridin-6-yl)methyl]hydrazine
CID 105256370
[cyclopropyl(thieno[3,2-b]pyridin-6-yl)methyl]hydrazine
CID 105256331
N-(2-cyclopentylethyl)-1-thieno[3,2-b]pyridin-6-ylethanamine
CID 64831341
N-[thieno[3,2-b]pyridin-6-yl(thiophen-3-yl)methyl]propan-1-amine
CID 81143136
N-[(3-chlorothiophen-2-yl)-thieno[3,2-b]pyridin-6-ylmethyl]propan-1-amine
CID 107360052
N-[2-(1,3-thiazol-2-yl)-1-thieno[3,2-b]pyridin-6-ylethyl]propan-1-amine
CID 81143134
N-[cycloheptyl(thieno[3,2-b]thiophen-5-yl)methyl]propan-1-amine
CID 105027664
(2-cyclopentyl-1-thieno[3,2-b]pyridin-6-ylethyl)hydrazine
CID 105256371
N-[(5-methylthiophen-2-yl)-thieno[3,2-b]pyridin-6-ylmethyl]propan-1-amine
CID 81143320
4,4,4-trifluoro-N-propyl-1-thieno[3,2-b]pyridin-6-ylbutan-1-amine
CID 81143135
2-[(1-thieno[3,2-b]pyridin-6-ylethylamino)methyl]cyclohexan-1-ol
CID 64928442

Frequently Asked Questions

What is the IUPAC name of N-[cyclopentyl(thieno[3,2-b]pyridin-6-yl)methyl]propan-1-amine?
The IUPAC name of N-[cyclopentyl(thieno[3,2-b]pyridin-6-yl)methyl]propan-1-amine (CID 81144181) is N-[cyclopentyl(thieno[3,2-b]pyridin-6-yl)methyl]propan-1-amine.
What is the SMILES notation for N-[cyclopentyl(thieno[3,2-b]pyridin-6-yl)methyl]propan-1-amine?
The canonical SMILES for N-[cyclopentyl(thieno[3,2-b]pyridin-6-yl)methyl]propan-1-amine is CCCNC(c1cnc2ccsc2c1)C1CCCC1.
What is the InChIKey of N-[cyclopentyl(thieno[3,2-b]pyridin-6-yl)methyl]propan-1-amine?
The InChIKey is JRHGJBHBFJMAMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2S/c1-2-8-17-16(12-5-3-4-6-12)13-10-15-14(18-11-13)7-9-19-15/h7,9-12,16-17H,2-6,8H2,1H3.
What are the key properties of N-[cyclopentyl(thieno[3,2-b]pyridin-6-yl)methyl]propan-1-amine?
N-[cyclopentyl(thieno[3,2-b]pyridin-6-yl)methyl]propan-1-amine has a molecular weight of 274.43 g/mol, XLogP of 4.53, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[cyclopentyl(thieno[3,2-b]pyridin-6-yl)methyl]propan-1-amine is sourced from PubChem (CID 81144181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).