N-(6-oxaspiro[4.5]decan-9-yl)thieno[3,2-b]pyridin-7-amine

C16H20N2OS — CID 133377793

IUPACN-(6-oxaspiro[4.5]decan-9-yl)thieno[3,2-b]pyridin-7-amine
SMILESc1cc(NC2CCOC3(CCCC3)C2)c2sccc2n1
InChIInChI=1S/C16H20N2OS/c1-2-7-16(6-1)11-12(4-9-19-16)18-14-3-8-17-13-5-10-20-15(13)14/h3,5,8,10,12H,1-2,4,6-7,9,11H2,(H,17,18)
InChIKeyZRVXOBSWZMRLSR-UHFFFAOYSA-N
MW288.42 g/mol
LogP4.20
Rot. Bonds2

About N-(6-oxaspiro[4.5]decan-9-yl)thieno[3,2-b]pyridin-7-amine

N-(6-oxaspiro[4.5]decan-9-yl)thieno[3,2-b]pyridin-7-amine (PubChem CID 133377793) has the molecular formula C16H20N2OS and a molecular weight of 288.42 g/mol. Its IUPAC name is N-(6-oxaspiro[4.5]decan-9-yl)thieno[3,2-b]pyridin-7-amine.

Molecular Properties

Compound NameN-(6-oxaspiro[4.5]decan-9-yl)thieno[3,2-b]pyridin-7-amine
PubChem CID133377793
Molecular FormulaC16H20N2OS
Molecular Weight288.42 g/mol
Exact Mass288.13
IUPAC NameN-(6-oxaspiro[4.5]decan-9-yl)thieno[3,2-b]pyridin-7-amine
SMILESc1cc(NC2CCOC3(CCCC3)C2)c2sccc2n1
InChIInChI=1S/C16H20N2OS/c1-2-7-16(6-1)11-12(4-9-19-16)18-14-3-8-17-13-5-10-20-15(13)14/h3,5,8,10,12H,1-2,4,6-7,9,11H2,(H,17,18)
InChIKeyZRVXOBSWZMRLSR-UHFFFAOYSA-N
XLogP4.20
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.42
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

8-methyl-N-(6-oxaspiro[4.5]decan-9-yl)quinolin-4-amine
CID 133377787
4-methyl-N-[(9R)-6-oxaspiro[4.5]decan-9-yl]pyrimidin-2-amine
CID 97234618
N-(2,4-dimethylphenyl)-1-oxaspiro[5.5]undecan-4-amine
CID 79898292
N-thiophen-3-yl-1-oxaspiro[5.5]undecan-4-amine
CID 79903550
N-(2,3-dimethylphenyl)-5-oxaspiro[3.5]nonan-8-amine
CID 79897570
N-(2-methylsulfanylphenyl)-6-oxaspiro[4.5]decan-9-amine
CID 107644684
N-naphthalen-1-yl-6-oxaspiro[4.5]decan-9-amine
CID 79901355
N-(1-oxaspiro[5.5]undecan-4-yl)-4-(trifluoromethyl)pyridin-2-amine
CID 133377961
N-(5-fluoro-2-methylphenyl)-5-oxaspiro[3.5]nonan-8-amine
CID 79898100
N-(2,5-dibromophenyl)-1-oxaspiro[5.5]undecan-4-amine
CID 79895723
1-cyclopropyl-4-(thieno[3,2-b]pyridin-7-ylamino)pyrrolidin-2-one
CID 133357410
N-(2-bromo-4-chlorophenyl)-6-oxaspiro[4.5]decan-9-amine
CID 81270688

Frequently Asked Questions

What is the IUPAC name of N-(6-oxaspiro[4.5]decan-9-yl)thieno[3,2-b]pyridin-7-amine?
The IUPAC name of N-(6-oxaspiro[4.5]decan-9-yl)thieno[3,2-b]pyridin-7-amine (CID 133377793) is N-(6-oxaspiro[4.5]decan-9-yl)thieno[3,2-b]pyridin-7-amine.
What is the SMILES notation for N-(6-oxaspiro[4.5]decan-9-yl)thieno[3,2-b]pyridin-7-amine?
The canonical SMILES for N-(6-oxaspiro[4.5]decan-9-yl)thieno[3,2-b]pyridin-7-amine is c1cc(NC2CCOC3(CCCC3)C2)c2sccc2n1.
What is the InChIKey of N-(6-oxaspiro[4.5]decan-9-yl)thieno[3,2-b]pyridin-7-amine?
The InChIKey is ZRVXOBSWZMRLSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2OS/c1-2-7-16(6-1)11-12(4-9-19-16)18-14-3-8-17-13-5-10-20-15(13)14/h3,5,8,10,12H,1-2,4,6-7,9,11H2,(H,17,18).
What are the key properties of N-(6-oxaspiro[4.5]decan-9-yl)thieno[3,2-b]pyridin-7-amine?
N-(6-oxaspiro[4.5]decan-9-yl)thieno[3,2-b]pyridin-7-amine has a molecular weight of 288.42 g/mol, XLogP of 4.20, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-oxaspiro[4.5]decan-9-yl)thieno[3,2-b]pyridin-7-amine is sourced from PubChem (CID 133377793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).