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

C13H17N3S — CID 114794635

IUPACN-(2-pyrrolidin-2-ylethyl)thieno[3,2-c]pyridin-4-amine
SMILESc1cc2sccc2c(NCCC2CCCN2)n1
InChIInChI=1S/C13H17N3S/c1-2-10(14-6-1)3-7-15-13-11-5-9-17-12(11)4-8-16-13/h4-5,8-10,14H,1-3,6-7H2,(H,15,16)
InChIKeyQCJASYCWGBXGGD-UHFFFAOYSA-N
MW247.37 g/mol
LogP2.85
Rot. Bonds4

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

N-(2-pyrrolidin-2-ylethyl)thieno[3,2-c]pyridin-4-amine (PubChem CID 114794635) has the molecular formula C13H17N3S and a molecular weight of 247.37 g/mol. Its IUPAC name is N-(2-pyrrolidin-2-ylethyl)thieno[3,2-c]pyridin-4-amine.

Molecular Properties

Compound NameN-(2-pyrrolidin-2-ylethyl)thieno[3,2-c]pyridin-4-amine
PubChem CID114794635
Molecular FormulaC13H17N3S
Molecular Weight247.37 g/mol
Exact Mass247.11
IUPAC NameN-(2-pyrrolidin-2-ylethyl)thieno[3,2-c]pyridin-4-amine
SMILESc1cc2sccc2c(NCCC2CCCN2)n1
InChIInChI=1S/C13H17N3S/c1-2-10(14-6-1)3-7-15-13-11-5-9-17-12(11)4-8-16-13/h4-5,8-10,14H,1-3,6-7H2,(H,15,16)
InChIKeyQCJASYCWGBXGGD-UHFFFAOYSA-N
XLogP2.85
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.37
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-cyclopentyloxyethyl)thieno[3,2-c]pyridin-4-amine
CID 55219716
3-bromo-4-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyridin-2-amine
CID 106876235
N-(2-methylpiperidin-3-yl)thieno[3,2-c]pyridin-4-amine
CID 114695478
6-methoxy-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]isoquinolin-1-amine
CID 106541129
3-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyridin-2-amine
CID 104973363
4-methyl-3-nitro-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyridin-2-amine
CID 104972861
3-methyl-N-(2-piperidin-2-ylethyl)pyridin-2-amine
CID 83837474
N-piperidin-4-ylthieno[3,2-c]pyridin-4-amine
CID 43522721
3-nitro-2-(2-pyrrolidin-2-ylethylamino)pyridine-4-carbonitrile
CID 114794553
N-[(3-aminocyclohexyl)methyl]thieno[3,2-c]pyridin-4-amine
CID 106128217
N-cyclopropyl-N-(piperidin-2-ylmethyl)thieno[3,2-c]pyridin-4-amine
CID 106641172
N-(1,2,3,6-tetrahydropyridin-4-ylmethyl)thieno[3,2-c]pyridin-4-amine
CID 114694489

Frequently Asked Questions

What is the IUPAC name of N-(2-pyrrolidin-2-ylethyl)thieno[3,2-c]pyridin-4-amine?
The IUPAC name of N-(2-pyrrolidin-2-ylethyl)thieno[3,2-c]pyridin-4-amine (CID 114794635) is N-(2-pyrrolidin-2-ylethyl)thieno[3,2-c]pyridin-4-amine.
What is the SMILES notation for N-(2-pyrrolidin-2-ylethyl)thieno[3,2-c]pyridin-4-amine?
The canonical SMILES for N-(2-pyrrolidin-2-ylethyl)thieno[3,2-c]pyridin-4-amine is c1cc2sccc2c(NCCC2CCCN2)n1.
What is the InChIKey of N-(2-pyrrolidin-2-ylethyl)thieno[3,2-c]pyridin-4-amine?
The InChIKey is QCJASYCWGBXGGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3S/c1-2-10(14-6-1)3-7-15-13-11-5-9-17-12(11)4-8-16-13/h4-5,8-10,14H,1-3,6-7H2,(H,15,16).
What are the key properties of N-(2-pyrrolidin-2-ylethyl)thieno[3,2-c]pyridin-4-amine?
N-(2-pyrrolidin-2-ylethyl)thieno[3,2-c]pyridin-4-amine has a molecular weight of 247.37 g/mol, XLogP of 2.85, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-pyrrolidin-2-ylethyl)thieno[3,2-c]pyridin-4-amine is sourced from PubChem (CID 114794635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).