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

C18H30N2S — CID 62615350

IUPAC2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)-4-methyl-N-propylcyclohexan-1-amine
SMILESCCCNC1CCC(C)CC1CN1CCc2sccc2C1
InChIInChI=1S/C18H30N2S/c1-3-8-19-17-5-4-14(2)11-16(17)13-20-9-6-18-15(12-20)7-10-21-18/h7,10,14,16-17,19H,3-6,8-9,11-13H2,1-2H3
InChIKeyMBKHSORMBKEABO-UHFFFAOYSA-N
MW306.52 g/mol
LogP3.91
Rot. Bonds5

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

2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)-4-methyl-N-propylcyclohexan-1-amine (PubChem CID 62615350) has the molecular formula C18H30N2S and a molecular weight of 306.52 g/mol. Its IUPAC name is 2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)-4-methyl-N-propylcyclohexan-1-amine.

Molecular Properties

Compound Name2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)-4-methyl-N-propylcyclohexan-1-amine
PubChem CID62615350
Molecular FormulaC18H30N2S
Molecular Weight306.52 g/mol
Exact Mass306.21
IUPAC Name2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)-4-methyl-N-propylcyclohexan-1-amine
SMILESCCCNC1CCC(C)CC1CN1CCc2sccc2C1
InChIInChI=1S/C18H30N2S/c1-3-8-19-17-5-4-14(2)11-16(17)13-20-9-6-18-15(12-20)7-10-21-18/h7,10,14,16-17,19H,3-6,8-9,11-13H2,1-2H3
InChIKeyMBKHSORMBKEABO-UHFFFAOYSA-N
XLogP3.91
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.52
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)-N-ethyl-4-methylcyclohexan-1-amine
CID 62615349
4-methyl-2-(piperidin-1-ylmethyl)-N-propylcyclohexan-1-amine
CID 62614642
2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)-4-propylcyclohexan-1-amine
CID 62615711
2-[(4,4-dimethylpiperidin-1-yl)methyl]-4-methyl-N-propylcyclohexan-1-amine
CID 63495442
2-[(3,4-dimethylpiperazin-1-yl)methyl]-4-methyl-N-propylcyclohexan-1-amine
CID 63635303
4-tert-butyl-2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)cyclohexan-1-ol
CID 62608999
2-[(4-methoxypiperidin-1-yl)methyl]-4-methyl-N-propylcyclohexan-1-amine
CID 62615391
5-(piperidin-4-ylmethyl)-6,7-dihydro-4H-thieno[3,2-c]pyridine;hydrochloride
CID 119929942
2-[[benzyl(methyl)amino]methyl]-4-methyl-N-propylcyclohexan-1-amine
CID 63483230
4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)cyclohexan-1-amine
CID 54928022
[4-[[5-methyl-2-(propylamino)cyclohexyl]methyl]morpholin-2-yl]methanol
CID 81214226
3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-ethylpropan-1-amine
CID 61386149

Frequently Asked Questions

What is the IUPAC name of 2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)-4-methyl-N-propylcyclohexan-1-amine?
The IUPAC name of 2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)-4-methyl-N-propylcyclohexan-1-amine (CID 62615350) is 2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)-4-methyl-N-propylcyclohexan-1-amine.
What is the SMILES notation for 2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)-4-methyl-N-propylcyclohexan-1-amine?
The canonical SMILES for 2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)-4-methyl-N-propylcyclohexan-1-amine is CCCNC1CCC(C)CC1CN1CCc2sccc2C1.
What is the InChIKey of 2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)-4-methyl-N-propylcyclohexan-1-amine?
The InChIKey is MBKHSORMBKEABO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2S/c1-3-8-19-17-5-4-14(2)11-16(17)13-20-9-6-18-15(12-20)7-10-21-18/h7,10,14,16-17,19H,3-6,8-9,11-13H2,1-2H3.
What are the key properties of 2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)-4-methyl-N-propylcyclohexan-1-amine?
2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)-4-methyl-N-propylcyclohexan-1-amine has a molecular weight of 306.52 g/mol, XLogP of 3.91, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylmethyl)-4-methyl-N-propylcyclohexan-1-amine is sourced from PubChem (CID 62615350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).