[1-[(thieno[3,2-c]pyridin-4-ylamino)methyl]cyclohexyl]methanol

C15H20N2OS — CID 112697561

IUPAC[1-[(thieno[3,2-c]pyridin-4-ylamino)methyl]cyclohexyl]methanol
SMILESOCC1(CNc2nccc3sccc23)CCCCC1
InChIInChI=1S/C15H20N2OS/c18-11-15(6-2-1-3-7-15)10-17-14-12-5-9-19-13(12)4-8-16-14/h4-5,8-9,18H,1-3,6-7,10-11H2,(H,16,17)
InChIKeyJDDWGROOYOXORY-UHFFFAOYSA-N
MW276.40 g/mol
LogP3.65
Rot. Bonds4

About [1-[(thieno[3,2-c]pyridin-4-ylamino)methyl]cyclohexyl]methanol

[1-[(thieno[3,2-c]pyridin-4-ylamino)methyl]cyclohexyl]methanol (PubChem CID 112697561) has the molecular formula C15H20N2OS and a molecular weight of 276.40 g/mol. Its IUPAC name is [1-[(thieno[3,2-c]pyridin-4-ylamino)methyl]cyclohexyl]methanol.

Molecular Properties

Compound Name[1-[(thieno[3,2-c]pyridin-4-ylamino)methyl]cyclohexyl]methanol
PubChem CID112697561
Molecular FormulaC15H20N2OS
Molecular Weight276.40 g/mol
Exact Mass276.13
IUPAC Name[1-[(thieno[3,2-c]pyridin-4-ylamino)methyl]cyclohexyl]methanol
SMILESOCC1(CNc2nccc3sccc23)CCCCC1
InChIInChI=1S/C15H20N2OS/c18-11-15(6-2-1-3-7-15)10-17-14-12-5-9-19-13(12)4-8-16-14/h4-5,8-9,18H,1-3,6-7,10-11H2,(H,16,17)
InChIKeyJDDWGROOYOXORY-UHFFFAOYSA-N
XLogP3.65
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.40
LogP ≤ 53.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze [1-[(thieno[3,2-c]pyridin-4-ylamino)methyl]cyclohexyl]methanol with MolForge

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Related Compounds

N-[[1-(chloromethyl)cyclopentyl]methyl]thieno[3,2-c]pyridin-4-amine
CID 113294681
N-[(1-methylcyclopentyl)methyl]thieno[3,2-c]pyridin-4-amine
CID 55261967
[1-(thieno[3,2-c]pyridin-4-ylamino)cyclopentyl]methanol
CID 62519052
N-[[1-(2-methoxyethyl)cyclopropyl]methyl]thieno[3,2-c]pyridin-4-amine
CID 103794661
N-[(1-methoxycyclobutyl)methyl]thieno[3,2-c]pyridin-4-amine
CID 103989642
N-[(2-methylthiolan-2-yl)methyl]thieno[3,2-c]pyridin-4-amine
CID 80527912
[1-[[(3-fluoro-2-pyridinyl)amino]methyl]cyclopentyl]methanol
CID 115360754
[3-methyl-1-(thieno[3,2-c]pyridin-4-ylamino)cyclohexyl]methanol
CID 62526536
[1-[[[2-(ethylamino)thieno[2,3-d]pyrimidin-4-yl]amino]methyl]cyclopentyl]methanol
CID 103329315
N-(2-chloroprop-2-enyl)thieno[3,2-c]pyridin-4-amine
CID 115637285
[1-[[(3-methylsulfonyl-2-pyridinyl)amino]methyl]cyclohexyl]methanol
CID 114599025
[1-[[(3-methoxy-2-pyridinyl)amino]methyl]cyclopentyl]methanol
CID 113371010

Frequently Asked Questions

What is the IUPAC name of [1-[(thieno[3,2-c]pyridin-4-ylamino)methyl]cyclohexyl]methanol?
The IUPAC name of [1-[(thieno[3,2-c]pyridin-4-ylamino)methyl]cyclohexyl]methanol (CID 112697561) is [1-[(thieno[3,2-c]pyridin-4-ylamino)methyl]cyclohexyl]methanol.
What is the SMILES notation for [1-[(thieno[3,2-c]pyridin-4-ylamino)methyl]cyclohexyl]methanol?
The canonical SMILES for [1-[(thieno[3,2-c]pyridin-4-ylamino)methyl]cyclohexyl]methanol is OCC1(CNc2nccc3sccc23)CCCCC1.
What is the InChIKey of [1-[(thieno[3,2-c]pyridin-4-ylamino)methyl]cyclohexyl]methanol?
The InChIKey is JDDWGROOYOXORY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2OS/c18-11-15(6-2-1-3-7-15)10-17-14-12-5-9-19-13(12)4-8-16-14/h4-5,8-9,18H,1-3,6-7,10-11H2,(H,16,17).
What are the key properties of [1-[(thieno[3,2-c]pyridin-4-ylamino)methyl]cyclohexyl]methanol?
[1-[(thieno[3,2-c]pyridin-4-ylamino)methyl]cyclohexyl]methanol has a molecular weight of 276.40 g/mol, XLogP of 3.65, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(thieno[3,2-c]pyridin-4-ylamino)methyl]cyclohexyl]methanol is sourced from PubChem (CID 112697561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).