3-amino-4,6-dimethyl-N-(oxan-3-yl)thieno[3,2-c]pyridine-2-carboxamide

C15H19N3O2S — CID 81037821

IUPAC3-amino-4,6-dimethyl-N-(oxan-3-yl)thieno[3,2-c]pyridine-2-carboxamide
SMILESCc1cc2sc(C(=O)NC3CCCOC3)c(N)c2c(C)n1
InChIInChI=1S/C15H19N3O2S/c1-8-6-11-12(9(2)17-8)13(16)14(21-11)15(19)18-10-4-3-5-20-7-10/h6,10H,3-5,7,16H2,1-2H3,(H,18,19)
InChIKeyUICZOAPRCABPNK-UHFFFAOYSA-N
MW305.40 g/mol
LogP2.40
Rot. Bonds2

About 3-amino-4,6-dimethyl-N-(oxan-3-yl)thieno[3,2-c]pyridine-2-carboxamide

3-amino-4,6-dimethyl-N-(oxan-3-yl)thieno[3,2-c]pyridine-2-carboxamide (PubChem CID 81037821) has the molecular formula C15H19N3O2S and a molecular weight of 305.40 g/mol. Its IUPAC name is 3-amino-4,6-dimethyl-N-(oxan-3-yl)thieno[3,2-c]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-4,6-dimethyl-N-(oxan-3-yl)thieno[3,2-c]pyridine-2-carboxamide
PubChem CID81037821
Molecular FormulaC15H19N3O2S
Molecular Weight305.40 g/mol
Exact Mass305.12
IUPAC Name3-amino-4,6-dimethyl-N-(oxan-3-yl)thieno[3,2-c]pyridine-2-carboxamide
SMILESCc1cc2sc(C(=O)NC3CCCOC3)c(N)c2c(C)n1
InChIInChI=1S/C15H19N3O2S/c1-8-6-11-12(9(2)17-8)13(16)14(21-11)15(19)18-10-4-3-5-20-7-10/h6,10H,3-5,7,16H2,1-2H3,(H,18,19)
InChIKeyUICZOAPRCABPNK-UHFFFAOYSA-N
XLogP2.40
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.40
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-amino-4,6-dimethyl-N-(oxolan-3-yl)thieno[3,2-c]pyridine-2-carboxamide
CID 81052702
3-amino-N-cyclohexyl-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide
CID 865531
3-amino-4,6-dimethyl-N-(thiolan-2-ylmethyl)thieno[3,2-c]pyridine-2-carboxamide
CID 81036990
3-amino-4,6-dimethyl-N-[3-(methylamino)propyl]thieno[3,2-c]pyridine-2-carboxamide
CID 81053330
2-[(3-amino-4,6-dimethylthieno[3,2-c]pyridine-2-carbonyl)amino]ethyl carbamate
CID 83206282
3-amino-N-(5-hydroxypentyl)-4,6-dimethylthieno[3,2-c]pyridine-2-carboxamide
CID 107323848
2-amino-4-methyl-N-(oxolan-3-yl)-1,3-thiazole-5-carboxamide
CID 80713116
3-amino-N-(1-amino-2-methyl-1-oxopropan-2-yl)-4,6-dimethylthieno[3,2-c]pyridine-2-carboxamide
CID 81037428
3-amino-4,6-dimethyl-N-(3,3,3-trifluoropropyl)thieno[3,2-c]pyridine-2-carboxamide
CID 81037438
3-amino-4,6-dimethyl-N-prop-2-enylthieno[3,2-c]pyridine-2-carboxamide
CID 81052779
(3-amino-4,6-dimethylthieno[3,2-c]pyridin-2-yl)-(3-methylpiperidin-1-yl)methanone
CID 81036363
3-amino-4,6-dimethyl-N-pentan-2-ylthieno[3,2-c]pyridine-2-carboxamide
CID 81053012

Frequently Asked Questions

What is the IUPAC name of 3-amino-4,6-dimethyl-N-(oxan-3-yl)thieno[3,2-c]pyridine-2-carboxamide?
The IUPAC name of 3-amino-4,6-dimethyl-N-(oxan-3-yl)thieno[3,2-c]pyridine-2-carboxamide (CID 81037821) is 3-amino-4,6-dimethyl-N-(oxan-3-yl)thieno[3,2-c]pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-4,6-dimethyl-N-(oxan-3-yl)thieno[3,2-c]pyridine-2-carboxamide?
The canonical SMILES for 3-amino-4,6-dimethyl-N-(oxan-3-yl)thieno[3,2-c]pyridine-2-carboxamide is Cc1cc2sc(C(=O)NC3CCCOC3)c(N)c2c(C)n1.
What is the InChIKey of 3-amino-4,6-dimethyl-N-(oxan-3-yl)thieno[3,2-c]pyridine-2-carboxamide?
The InChIKey is UICZOAPRCABPNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2S/c1-8-6-11-12(9(2)17-8)13(16)14(21-11)15(19)18-10-4-3-5-20-7-10/h6,10H,3-5,7,16H2,1-2H3,(H,18,19).
What are the key properties of 3-amino-4,6-dimethyl-N-(oxan-3-yl)thieno[3,2-c]pyridine-2-carboxamide?
3-amino-4,6-dimethyl-N-(oxan-3-yl)thieno[3,2-c]pyridine-2-carboxamide has a molecular weight of 305.40 g/mol, XLogP of 2.40, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-4,6-dimethyl-N-(oxan-3-yl)thieno[3,2-c]pyridine-2-carboxamide is sourced from PubChem (CID 81037821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).