N-(2,3,3-trimethylbutyl)thieno[3,2-c]pyridin-4-amine

C14H20N2S — CID 83143600

IUPACN-(2,3,3-trimethylbutyl)thieno[3,2-c]pyridin-4-amine
SMILESCC(CNc1nccc2sccc12)C(C)(C)C
InChIInChI=1S/C14H20N2S/c1-10(14(2,3)4)9-16-13-11-6-8-17-12(11)5-7-15-13/h5-8,10H,9H2,1-4H3,(H,15,16)
InChIKeyNCRINZQMLWNPRR-UHFFFAOYSA-N
MW248.39 g/mol
LogP4.39
Rot. Bonds3

About N-(2,3,3-trimethylbutyl)thieno[3,2-c]pyridin-4-amine

N-(2,3,3-trimethylbutyl)thieno[3,2-c]pyridin-4-amine (PubChem CID 83143600) has the molecular formula C14H20N2S and a molecular weight of 248.39 g/mol. Its IUPAC name is N-(2,3,3-trimethylbutyl)thieno[3,2-c]pyridin-4-amine.

Molecular Properties

Compound NameN-(2,3,3-trimethylbutyl)thieno[3,2-c]pyridin-4-amine
PubChem CID83143600
Molecular FormulaC14H20N2S
Molecular Weight248.39 g/mol
Exact Mass248.13
IUPAC NameN-(2,3,3-trimethylbutyl)thieno[3,2-c]pyridin-4-amine
SMILESCC(CNc1nccc2sccc12)C(C)(C)C
InChIInChI=1S/C14H20N2S/c1-10(14(2,3)4)9-16-13-11-6-8-17-12(11)5-7-15-13/h5-8,10H,9H2,1-4H3,(H,15,16)
InChIKeyNCRINZQMLWNPRR-UHFFFAOYSA-N
XLogP4.39
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.39
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(2,3,3-trimethylbutyl)thieno[3,2-c]pyridin-4-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

N-(2,2-dimethoxyethyl)thieno[3,2-c]pyridin-4-amine
CID 107390126
N-(2-methyl-3-pyrrolidin-1-ylpropyl)thieno[3,2-c]pyridin-4-amine
CID 62992310
N-tert-butylthieno[3,2-c]pyridin-4-amine
CID 126975731
2,3-dimethyl-2-N-thieno[3,2-c]pyridin-4-ylbutane-1,2-diamine
CID 113284061
N-(2-chloro-2-phenylethyl)thieno[3,2-c]pyridin-4-amine
CID 65027465
2-methoxy-3-(thieno[3,2-c]pyridin-4-ylamino)propanoic acid
CID 106108525
N-(3-methylsulfonylpropyl)thieno[3,2-c]pyridin-4-amine
CID 54905473
N-pentan-2-ylthieno[3,2-c]pyridin-4-amine
CID 43522745
2-ethyl-2-[(thieno[3,2-c]pyridin-4-ylamino)methyl]butan-1-ol
CID 103844406
N-methyl-2-(thieno[3,2-c]pyridin-4-ylamino)acetamide
CID 43522799
N-[(E)-pent-3-enyl]thieno[3,2-c]pyridin-4-amine
CID 115628494
N-(2-chloroprop-2-enyl)thieno[3,2-c]pyridin-4-amine
CID 115637285

Frequently Asked Questions

What is the IUPAC name of N-(2,3,3-trimethylbutyl)thieno[3,2-c]pyridin-4-amine?
The IUPAC name of N-(2,3,3-trimethylbutyl)thieno[3,2-c]pyridin-4-amine (CID 83143600) is N-(2,3,3-trimethylbutyl)thieno[3,2-c]pyridin-4-amine.
What is the SMILES notation for N-(2,3,3-trimethylbutyl)thieno[3,2-c]pyridin-4-amine?
The canonical SMILES for N-(2,3,3-trimethylbutyl)thieno[3,2-c]pyridin-4-amine is CC(CNc1nccc2sccc12)C(C)(C)C.
What is the InChIKey of N-(2,3,3-trimethylbutyl)thieno[3,2-c]pyridin-4-amine?
The InChIKey is NCRINZQMLWNPRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2S/c1-10(14(2,3)4)9-16-13-11-6-8-17-12(11)5-7-15-13/h5-8,10H,9H2,1-4H3,(H,15,16).
What are the key properties of N-(2,3,3-trimethylbutyl)thieno[3,2-c]pyridin-4-amine?
N-(2,3,3-trimethylbutyl)thieno[3,2-c]pyridin-4-amine has a molecular weight of 248.39 g/mol, XLogP of 4.39, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3,3-trimethylbutyl)thieno[3,2-c]pyridin-4-amine is sourced from PubChem (CID 83143600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).