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

C13H15N3S — CID 55011051

IUPAC4-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyridin-3-amine
SMILESCC1c2ccsc2CCN1c1ccncc1N
InChIInChI=1S/C13H15N3S/c1-9-10-4-7-17-13(10)3-6-16(9)12-2-5-15-8-11(12)14/h2,4-5,7-9H,3,6,14H2,1H3
InChIKeyJFZJSSISTXRXHI-UHFFFAOYSA-N
MW245.35 g/mol
LogP2.85
Rot. Bonds1

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

4-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyridin-3-amine (PubChem CID 55011051) has the molecular formula C13H15N3S and a molecular weight of 245.35 g/mol. Its IUPAC name is 4-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyridin-3-amine.

Molecular Properties

Compound Name4-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyridin-3-amine
PubChem CID55011051
Molecular FormulaC13H15N3S
Molecular Weight245.35 g/mol
Exact Mass245.10
IUPAC Name4-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyridin-3-amine
SMILESCC1c2ccsc2CCN1c1ccncc1N
InChIInChI=1S/C13H15N3S/c1-9-10-4-7-17-13(10)3-6-16(9)12-2-5-15-8-11(12)14/h2,4-5,7-9H,3,6,14H2,1H3
InChIKeyJFZJSSISTXRXHI-UHFFFAOYSA-N
XLogP2.85
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.35
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyridin-3-amine?
The IUPAC name of 4-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyridin-3-amine (CID 55011051) is 4-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyridin-3-amine.
What is the SMILES notation for 4-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyridin-3-amine?
The canonical SMILES for 4-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyridin-3-amine is CC1c2ccsc2CCN1c1ccncc1N.
What is the InChIKey of 4-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyridin-3-amine?
The InChIKey is JFZJSSISTXRXHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3S/c1-9-10-4-7-17-13(10)3-6-16(9)12-2-5-15-8-11(12)14/h2,4-5,7-9H,3,6,14H2,1H3.
What are the key properties of 4-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyridin-3-amine?
4-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyridin-3-amine has a molecular weight of 245.35 g/mol, XLogP of 2.85, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyridin-3-amine is sourced from PubChem (CID 55011051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).