4-ethyl-N-methyl-2-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methyl]cyclohexan-1-amine

C18H30N2S — CID 62611015

IUPAC4-ethyl-N-methyl-2-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methyl]cyclohexan-1-amine
SMILESCCC1CCC(NC)C(CN2CCc3sccc3C2C)C1
InChIInChI=1S/C18H30N2S/c1-4-14-5-6-17(19-3)15(11-14)12-20-9-7-18-16(13(20)2)8-10-21-18/h8,10,13-15,17,19H,4-7,9,11-12H2,1-3H3
InChIKeySQVKKSXECHWABE-UHFFFAOYSA-N
MW306.52 g/mol
LogP4.08
Rot. Bonds4

About 4-ethyl-N-methyl-2-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methyl]cyclohexan-1-amine

4-ethyl-N-methyl-2-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methyl]cyclohexan-1-amine (PubChem CID 62611015) has the molecular formula C18H30N2S and a molecular weight of 306.52 g/mol. Its IUPAC name is 4-ethyl-N-methyl-2-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name4-ethyl-N-methyl-2-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methyl]cyclohexan-1-amine
PubChem CID62611015
Molecular FormulaC18H30N2S
Molecular Weight306.52 g/mol
Exact Mass306.21
IUPAC Name4-ethyl-N-methyl-2-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methyl]cyclohexan-1-amine
SMILESCCC1CCC(NC)C(CN2CCc3sccc3C2C)C1
InChIInChI=1S/C18H30N2S/c1-4-14-5-6-17(19-3)15(11-14)12-20-9-7-18-16(13(20)2)8-10-21-18/h8,10,13-15,17,19H,4-7,9,11-12H2,1-3H3
InChIKeySQVKKSXECHWABE-UHFFFAOYSA-N
XLogP4.08
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.52
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-ethyl-N-methyl-2-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methyl]cyclohexan-1-amine with MolForge

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Related Compounds

4-methyl-5-(piperidin-4-ylmethyl)-6,7-dihydro-4H-thieno[3,2-c]pyridine;hydrochloride
CID 119929810
3,5-dimethyl-2-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methyl]cyclohexan-1-amine
CID 64735839
5-[(4-methoxypyrrolidin-2-yl)methyl]-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridine
CID 55009354
2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)acetonitrile
CID 60699782
4-ethyl-N-methyl-2-[(3-methylsulfonylthiomorpholin-4-yl)methyl]cyclohexan-1-amine
CID 66383602
2-methyl-1-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pentan-2-amine
CID 55008664
2-cyclopropyl-1-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propan-2-amine
CID 55009206
2-methyl-1-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)butan-2-ol
CID 114495544
2-ethyl-2-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methyl]-N-propylbutan-1-amine
CID 63495889
1-ethyl-3-[[(4R)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methyl]imidazolidine-2,4,5-trione
CID 9321548
methyl 2-methyl-3-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propanoate
CID 54939954
4-methyl-5-(1,2,3,4-tetrahydroquinolin-3-ylmethyl)-6,7-dihydro-4H-thieno[3,2-c]pyridine
CID 106902106

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-methyl-2-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methyl]cyclohexan-1-amine?
The IUPAC name of 4-ethyl-N-methyl-2-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methyl]cyclohexan-1-amine (CID 62611015) is 4-ethyl-N-methyl-2-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methyl]cyclohexan-1-amine.
What is the SMILES notation for 4-ethyl-N-methyl-2-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methyl]cyclohexan-1-amine?
The canonical SMILES for 4-ethyl-N-methyl-2-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methyl]cyclohexan-1-amine is CCC1CCC(NC)C(CN2CCc3sccc3C2C)C1.
What is the InChIKey of 4-ethyl-N-methyl-2-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methyl]cyclohexan-1-amine?
The InChIKey is SQVKKSXECHWABE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2S/c1-4-14-5-6-17(19-3)15(11-14)12-20-9-7-18-16(13(20)2)8-10-21-18/h8,10,13-15,17,19H,4-7,9,11-12H2,1-3H3.
What are the key properties of 4-ethyl-N-methyl-2-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methyl]cyclohexan-1-amine?
4-ethyl-N-methyl-2-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methyl]cyclohexan-1-amine has a molecular weight of 306.52 g/mol, XLogP of 4.08, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-methyl-2-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methyl]cyclohexan-1-amine is sourced from PubChem (CID 62611015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).