8-methyl-N-[(1R)-1-thiophen-2-ylethyl]-8-azabicyclo[3.2.1]octan-3-amine

C14H22N2S — CID 81398172

IUPAC8-methyl-N-[(1R)-1-thiophen-2-ylethyl]-8-azabicyclo[3.2.1]octan-3-amine
SMILESC[C@@H](NC1CC2CCC(C1)N2C)c1cccs1
InChIInChI=1S/C14H22N2S/c1-10(14-4-3-7-17-14)15-11-8-12-5-6-13(9-11)16(12)2/h3-4,7,10-13,15H,5-6,8-9H2,1-2H3/t10-,11?,12?,13?/m1/s1
InChIKeyCEQJZKFRHZADRW-PEWWYSNMSA-N
MW250.41 g/mol
LogP3.02
Rot. Bonds3

About 8-methyl-N-[(1R)-1-thiophen-2-ylethyl]-8-azabicyclo[3.2.1]octan-3-amine

8-methyl-N-[(1R)-1-thiophen-2-ylethyl]-8-azabicyclo[3.2.1]octan-3-amine (PubChem CID 81398172) has the molecular formula C14H22N2S and a molecular weight of 250.41 g/mol. Its IUPAC name is 8-methyl-N-[(1R)-1-thiophen-2-ylethyl]-8-azabicyclo[3.2.1]octan-3-amine.

Molecular Properties

Compound Name8-methyl-N-[(1R)-1-thiophen-2-ylethyl]-8-azabicyclo[3.2.1]octan-3-amine
PubChem CID81398172
Molecular FormulaC14H22N2S
Molecular Weight250.41 g/mol
Exact Mass250.15
IUPAC Name8-methyl-N-[(1R)-1-thiophen-2-ylethyl]-8-azabicyclo[3.2.1]octan-3-amine
SMILESC[C@@H](NC1CC2CCC(C1)N2C)c1cccs1
InChIInChI=1S/C14H22N2S/c1-10(14-4-3-7-17-14)15-11-8-12-5-6-13(9-11)16(12)2/h3-4,7,10-13,15H,5-6,8-9H2,1-2H3/t10-,11?,12?,13?/m1/s1
InChIKeyCEQJZKFRHZADRW-PEWWYSNMSA-N
XLogP3.02
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.41
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 8-methyl-N-[(1R)-1-thiophen-2-ylethyl]-8-azabicyclo[3.2.1]octan-3-amine with MolForge

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Related Compounds

1-cyclopropyl-5-methyl-N-[(1R)-1-thiophen-2-ylethyl]pyrrolidin-3-amine
CID 113491658
N-(1-thiophen-2-ylethyl)cyclohexanamine
CID 25219735
1-propan-2-yl-N-(1-thiophen-2-ylethyl)piperidin-4-amine
CID 43182947
3-propan-2-yl-N-(1-thiophen-2-ylethyl)cyclohexan-1-amine
CID 107447910
N-[(1R)-1-thiophen-2-ylethyl]oxolan-3-amine
CID 81398410
N-[(1S)-1-thiophen-2-ylethyl]oxolan-3-amine
CID 81398144
4-(1-thiophen-2-ylethylamino)cyclohexan-1-ol
CID 43193909
9-methyl-N-[1-(5-methylthiophen-2-yl)ethyl]-9-azabicyclo[3.3.1]nonan-3-amine
CID 65471234
N-[(1R)-1-thiophen-2-ylethyl]piperidin-3-amine
CID 81398343
4-tert-butyl-N-[(1R)-1-thiophen-2-ylethyl]cyclohexan-1-amine
CID 28544170
1-(2-methylpropyl)-N-(1-thiophen-2-ylethyl)piperidin-4-amine
CID 103775855
(3R)-N-(1-thiophen-2-ylethyl)piperidin-3-amine;hydrochloride
CID 71637623

Frequently Asked Questions

What is the IUPAC name of 8-methyl-N-[(1R)-1-thiophen-2-ylethyl]-8-azabicyclo[3.2.1]octan-3-amine?
The IUPAC name of 8-methyl-N-[(1R)-1-thiophen-2-ylethyl]-8-azabicyclo[3.2.1]octan-3-amine (CID 81398172) is 8-methyl-N-[(1R)-1-thiophen-2-ylethyl]-8-azabicyclo[3.2.1]octan-3-amine.
What is the SMILES notation for 8-methyl-N-[(1R)-1-thiophen-2-ylethyl]-8-azabicyclo[3.2.1]octan-3-amine?
The canonical SMILES for 8-methyl-N-[(1R)-1-thiophen-2-ylethyl]-8-azabicyclo[3.2.1]octan-3-amine is C[C@@H](NC1CC2CCC(C1)N2C)c1cccs1.
What is the InChIKey of 8-methyl-N-[(1R)-1-thiophen-2-ylethyl]-8-azabicyclo[3.2.1]octan-3-amine?
The InChIKey is CEQJZKFRHZADRW-PEWWYSNMSA-N. The full InChI is InChI=1S/C14H22N2S/c1-10(14-4-3-7-17-14)15-11-8-12-5-6-13(9-11)16(12)2/h3-4,7,10-13,15H,5-6,8-9H2,1-2H3/t10-,11?,12?,13?/m1/s1.
What are the key properties of 8-methyl-N-[(1R)-1-thiophen-2-ylethyl]-8-azabicyclo[3.2.1]octan-3-amine?
8-methyl-N-[(1R)-1-thiophen-2-ylethyl]-8-azabicyclo[3.2.1]octan-3-amine has a molecular weight of 250.41 g/mol, XLogP of 3.02, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-N-[(1R)-1-thiophen-2-ylethyl]-8-azabicyclo[3.2.1]octan-3-amine is sourced from PubChem (CID 81398172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).