[1-[(1-thieno[3,2-b]pyridin-6-ylethylamino)methyl]cyclohexyl]methanol

C17H24N2OS — CID 115892911

IUPAC[1-[(1-thieno[3,2-b]pyridin-6-ylethylamino)methyl]cyclohexyl]methanol
SMILESCC(NCC1(CO)CCCCC1)c1cnc2ccsc2c1
InChIInChI=1S/C17H24N2OS/c1-13(14-9-16-15(18-10-14)5-8-21-16)19-11-17(12-20)6-3-2-4-7-17/h5,8-10,13,19-20H,2-4,6-7,11-12H2,1H3
InChIKeyJBSOHFNTYIDXDH-UHFFFAOYSA-N
MW304.46 g/mol
LogP3.89
Rot. Bonds5

About [1-[(1-thieno[3,2-b]pyridin-6-ylethylamino)methyl]cyclohexyl]methanol

[1-[(1-thieno[3,2-b]pyridin-6-ylethylamino)methyl]cyclohexyl]methanol (PubChem CID 115892911) has the molecular formula C17H24N2OS and a molecular weight of 304.46 g/mol. Its IUPAC name is [1-[(1-thieno[3,2-b]pyridin-6-ylethylamino)methyl]cyclohexyl]methanol.

Molecular Properties

Compound Name[1-[(1-thieno[3,2-b]pyridin-6-ylethylamino)methyl]cyclohexyl]methanol
PubChem CID115892911
Molecular FormulaC17H24N2OS
Molecular Weight304.46 g/mol
Exact Mass304.16
IUPAC Name[1-[(1-thieno[3,2-b]pyridin-6-ylethylamino)methyl]cyclohexyl]methanol
SMILESCC(NCC1(CO)CCCCC1)c1cnc2ccsc2c1
InChIInChI=1S/C17H24N2OS/c1-13(14-9-16-15(18-10-14)5-8-21-16)19-11-17(12-20)6-3-2-4-7-17/h5,8-10,13,19-20H,2-4,6-7,11-12H2,1H3
InChIKeyJBSOHFNTYIDXDH-UHFFFAOYSA-N
XLogP3.89
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.46
LogP ≤ 53.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze [1-[(1-thieno[3,2-b]pyridin-6-ylethylamino)methyl]cyclohexyl]methanol with MolForge

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Related Compounds

N-[(4-methyloxan-4-yl)methyl]-1-thieno[3,2-b]pyridin-6-ylethanamine
CID 103903352
2-[(1-thieno[3,2-b]pyridin-6-ylethylamino)methyl]cyclohexan-1-ol
CID 64928442
2-(1-thieno[3,2-b]pyridin-6-ylethylamino)acetic acid
CID 64828783
N-(2-cyclopentylethyl)-1-thieno[3,2-b]pyridin-6-ylethanamine
CID 64831341
2,2-dimethyl-3-(1-thieno[3,2-b]pyridin-6-ylethylamino)propan-1-ol
CID 115359066
(2S)-2-(1-thieno[3,2-b]pyridin-6-ylethylamino)propan-1-ol
CID 103789089
[1-[[[(1R)-1-pyridin-4-ylethyl]amino]methyl]cyclohexyl]methanol
CID 81419096
N-[2-(1-thieno[3,2-b]pyridin-6-ylethylamino)ethyl]acetamide
CID 64829172
N-tert-butyl-3-(1-thieno[3,2-b]pyridin-6-ylethylamino)propanamide
CID 115889391
N'-(1-thieno[3,2-b]pyridin-6-ylethyl)butane-1,4-diamine
CID 64830758
[1-[[1-(3,5-dimethylphenyl)ethylamino]methyl]cyclohexyl]methanol
CID 103965989
4-[2-(1-thieno[3,2-b]pyridin-6-ylethylamino)ethyl]phenol
CID 64830374

Frequently Asked Questions

What is the IUPAC name of [1-[(1-thieno[3,2-b]pyridin-6-ylethylamino)methyl]cyclohexyl]methanol?
The IUPAC name of [1-[(1-thieno[3,2-b]pyridin-6-ylethylamino)methyl]cyclohexyl]methanol (CID 115892911) is [1-[(1-thieno[3,2-b]pyridin-6-ylethylamino)methyl]cyclohexyl]methanol.
What is the SMILES notation for [1-[(1-thieno[3,2-b]pyridin-6-ylethylamino)methyl]cyclohexyl]methanol?
The canonical SMILES for [1-[(1-thieno[3,2-b]pyridin-6-ylethylamino)methyl]cyclohexyl]methanol is CC(NCC1(CO)CCCCC1)c1cnc2ccsc2c1.
What is the InChIKey of [1-[(1-thieno[3,2-b]pyridin-6-ylethylamino)methyl]cyclohexyl]methanol?
The InChIKey is JBSOHFNTYIDXDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2OS/c1-13(14-9-16-15(18-10-14)5-8-21-16)19-11-17(12-20)6-3-2-4-7-17/h5,8-10,13,19-20H,2-4,6-7,11-12H2,1H3.
What are the key properties of [1-[(1-thieno[3,2-b]pyridin-6-ylethylamino)methyl]cyclohexyl]methanol?
[1-[(1-thieno[3,2-b]pyridin-6-ylethylamino)methyl]cyclohexyl]methanol has a molecular weight of 304.46 g/mol, XLogP of 3.89, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(1-thieno[3,2-b]pyridin-6-ylethylamino)methyl]cyclohexyl]methanol is sourced from PubChem (CID 115892911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).