[1-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]cyclohexyl]methanamine

C16H26N2S — CID 104678673

IUPAC[1-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]cyclohexyl]methanamine
SMILESNCC1(CCN2CCc3sccc3C2)CCCCC1
InChIInChI=1S/C16H26N2S/c17-13-16(6-2-1-3-7-16)8-10-18-9-4-15-14(12-18)5-11-19-15/h5,11H,1-4,6-10,12-13,17H2
InChIKeyKJLBIPZKZNAZAG-UHFFFAOYSA-N
MW278.46 g/mol
LogP3.41
Rot. Bonds4

About [1-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]cyclohexyl]methanamine

[1-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]cyclohexyl]methanamine (PubChem CID 104678673) has the molecular formula C16H26N2S and a molecular weight of 278.46 g/mol. Its IUPAC name is [1-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]cyclohexyl]methanamine.

Molecular Properties

Compound Name[1-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]cyclohexyl]methanamine
PubChem CID104678673
Molecular FormulaC16H26N2S
Molecular Weight278.46 g/mol
Exact Mass278.18
IUPAC Name[1-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]cyclohexyl]methanamine
SMILESNCC1(CCN2CCc3sccc3C2)CCCCC1
InChIInChI=1S/C16H26N2S/c17-13-16(6-2-1-3-7-16)8-10-18-9-4-15-14(12-18)5-11-19-15/h5,11H,1-4,6-10,12-13,17H2
InChIKeyKJLBIPZKZNAZAG-UHFFFAOYSA-N
XLogP3.41
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.46
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]cyclohexyl]methanamine
CID 104678682
[1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]cyclopropyl]methanamine
CID 84793998
1-[1-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)cyclohexyl]-N-methylmethanamine
CID 62262459
5-(3-iodopropyl)-6,7-dihydro-4H-thieno[3,2-c]pyridine
CID 130634537
1-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)cyclopentane-1-carbaldehyde
CID 62277127
5-(2,2-dimethylpropyl)-6,7-dihydro-4H-thieno[3,2-c]pyridine
CID 176622093
5-(3-phenylpropyl)-6,7-dihydro-4H-thieno[3,2-c]pyridine
CID 52551128
5-[2-(1,4-diazepan-1-yl)ethyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine
CID 55121504
5-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-methylpentan-1-amine
CID 62437630
2-amino-N-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]acetamide;dihydrochloride
CID 119862338
[1-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]triazol-4-yl]methanamine
CID 55069976
5-[2-(9-pyridin-2-yl-6-oxaspiro[4.5]decan-9-yl)ethyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine;hydrochloride
CID 174938354

Frequently Asked Questions

What is the IUPAC name of [1-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]cyclohexyl]methanamine?
The IUPAC name of [1-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]cyclohexyl]methanamine (CID 104678673) is [1-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]cyclohexyl]methanamine.
What is the SMILES notation for [1-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]cyclohexyl]methanamine?
The canonical SMILES for [1-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]cyclohexyl]methanamine is NCC1(CCN2CCc3sccc3C2)CCCCC1.
What is the InChIKey of [1-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]cyclohexyl]methanamine?
The InChIKey is KJLBIPZKZNAZAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2S/c17-13-16(6-2-1-3-7-16)8-10-18-9-4-15-14(12-18)5-11-19-15/h5,11H,1-4,6-10,12-13,17H2.
What are the key properties of [1-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]cyclohexyl]methanamine?
[1-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]cyclohexyl]methanamine has a molecular weight of 278.46 g/mol, XLogP of 3.41, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]cyclohexyl]methanamine is sourced from PubChem (CID 104678673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).