N,N,3-trimethyl-1-(2-methylthieno[2,3-b]pyridin-6-yl)pyrrolidin-3-amine

C15H21N3S — CID 170747520

IUPACN,N,3-trimethyl-1-(2-methylthieno[2,3-b]pyridin-6-yl)pyrrolidin-3-amine
SMILESCc1cc2ccc(N3CCC(C)(N(C)C)C3)nc2s1
InChIInChI=1S/C15H21N3S/c1-11-9-12-5-6-13(16-14(12)19-11)18-8-7-15(2,10-18)17(3)4/h5-6,9H,7-8,10H2,1-4H3
InChIKeyUEPUEQJTZANFRV-UHFFFAOYSA-N
MW275.42 g/mol
LogP3.14
Rot. Bonds2

About N,N,3-trimethyl-1-(2-methylthieno[2,3-b]pyridin-6-yl)pyrrolidin-3-amine

N,N,3-trimethyl-1-(2-methylthieno[2,3-b]pyridin-6-yl)pyrrolidin-3-amine (PubChem CID 170747520) has the molecular formula C15H21N3S and a molecular weight of 275.42 g/mol. Its IUPAC name is N,N,3-trimethyl-1-(2-methylthieno[2,3-b]pyridin-6-yl)pyrrolidin-3-amine.

Molecular Properties

Compound NameN,N,3-trimethyl-1-(2-methylthieno[2,3-b]pyridin-6-yl)pyrrolidin-3-amine
PubChem CID170747520
Molecular FormulaC15H21N3S
Molecular Weight275.42 g/mol
Exact Mass275.15
IUPAC NameN,N,3-trimethyl-1-(2-methylthieno[2,3-b]pyridin-6-yl)pyrrolidin-3-amine
SMILESCc1cc2ccc(N3CCC(C)(N(C)C)C3)nc2s1
InChIInChI=1S/C15H21N3S/c1-11-9-12-5-6-13(16-14(12)19-11)18-8-7-15(2,10-18)17(3)4/h5-6,9H,7-8,10H2,1-4H3
InChIKeyUEPUEQJTZANFRV-UHFFFAOYSA-N
XLogP3.14
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.42
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N,3-trimethyl-1-(2-methylthieno[2,3-b]pyridin-6-yl)pyrrolidin-3-amine?
The IUPAC name of N,N,3-trimethyl-1-(2-methylthieno[2,3-b]pyridin-6-yl)pyrrolidin-3-amine (CID 170747520) is N,N,3-trimethyl-1-(2-methylthieno[2,3-b]pyridin-6-yl)pyrrolidin-3-amine.
What is the SMILES notation for N,N,3-trimethyl-1-(2-methylthieno[2,3-b]pyridin-6-yl)pyrrolidin-3-amine?
The canonical SMILES for N,N,3-trimethyl-1-(2-methylthieno[2,3-b]pyridin-6-yl)pyrrolidin-3-amine is Cc1cc2ccc(N3CCC(C)(N(C)C)C3)nc2s1.
What is the InChIKey of N,N,3-trimethyl-1-(2-methylthieno[2,3-b]pyridin-6-yl)pyrrolidin-3-amine?
The InChIKey is UEPUEQJTZANFRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3S/c1-11-9-12-5-6-13(16-14(12)19-11)18-8-7-15(2,10-18)17(3)4/h5-6,9H,7-8,10H2,1-4H3.
What are the key properties of N,N,3-trimethyl-1-(2-methylthieno[2,3-b]pyridin-6-yl)pyrrolidin-3-amine?
N,N,3-trimethyl-1-(2-methylthieno[2,3-b]pyridin-6-yl)pyrrolidin-3-amine has a molecular weight of 275.42 g/mol, XLogP of 3.14, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,3-trimethyl-1-(2-methylthieno[2,3-b]pyridin-6-yl)pyrrolidin-3-amine is sourced from PubChem (CID 170747520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).