2-(diethylaminomethyl)-N-methylthieno[2,3-d]pyrimidin-4-amine

C12H18N4S — CID 62178753

IUPAC2-(diethylaminomethyl)-N-methylthieno[2,3-d]pyrimidin-4-amine
SMILESCCN(CC)Cc1nc(NC)c2ccsc2n1
InChIInChI=1S/C12H18N4S/c1-4-16(5-2)8-10-14-11(13-3)9-6-7-17-12(9)15-10/h6-7H,4-5,8H2,1-3H3,(H,13,14,15)
InChIKeyYQEXZKYXAILBKZ-UHFFFAOYSA-N
MW250.37 g/mol
LogP2.57
Rot. Bonds5

About 2-(diethylaminomethyl)-N-methylthieno[2,3-d]pyrimidin-4-amine

2-(diethylaminomethyl)-N-methylthieno[2,3-d]pyrimidin-4-amine (PubChem CID 62178753) has the molecular formula C12H18N4S and a molecular weight of 250.37 g/mol. Its IUPAC name is 2-(diethylaminomethyl)-N-methylthieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-(diethylaminomethyl)-N-methylthieno[2,3-d]pyrimidin-4-amine
PubChem CID62178753
Molecular FormulaC12H18N4S
Molecular Weight250.37 g/mol
Exact Mass250.13
IUPAC Name2-(diethylaminomethyl)-N-methylthieno[2,3-d]pyrimidin-4-amine
SMILESCCN(CC)Cc1nc(NC)c2ccsc2n1
InChIInChI=1S/C12H18N4S/c1-4-16(5-2)8-10-14-11(13-3)9-6-7-17-12(9)15-10/h6-7H,4-5,8H2,1-3H3,(H,13,14,15)
InChIKeyYQEXZKYXAILBKZ-UHFFFAOYSA-N
XLogP2.57
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.37
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(diethylaminomethyl)-N-methylthieno[2,3-d]pyrimidin-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

2-[[ethyl(propyl)amino]methyl]-N-methylthieno[2,3-d]pyrimidin-4-amine
CID 62182196
2-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]-N-methylthieno[2,3-d]pyrimidin-4-amine
CID 62184210
2-[[2-ethoxyethyl(ethyl)amino]methyl]-N-methylthieno[2,3-d]pyrimidin-4-amine
CID 63692488
2-butyl-N-methylthieno[2,3-d]pyrimidin-4-amine
CID 79412131
N-ethyl-2,2,2-trifluoro-N-[(4-hydrazinylthieno[2,3-d]pyrimidin-2-yl)methyl]ethanamine
CID 62245884
2-[[1-cyclopropylethyl(methyl)amino]methyl]-N-methylthieno[2,3-d]pyrimidin-4-amine
CID 62182231
2-[[2-methoxyethyl(propan-2-yl)amino]methyl]-N-methylthieno[2,3-d]pyrimidin-4-amine
CID 82953478
2-[[(4-bromothiophen-2-yl)methyl-methylamino]methyl]-N-methylthieno[2,3-d]pyrimidin-4-amine
CID 62183349
2-[cyclopropyl-[[4-(methylamino)thieno[2,3-d]pyrimidin-2-yl]methyl]amino]ethanol
CID 62208644
N-methyl-2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]thieno[2,3-d]pyrimidin-4-amine
CID 81074567
2-[(N,3-dimethylanilino)methyl]-N-methylthieno[2,3-d]pyrimidin-4-amine
CID 62184069
2-(tert-butylsulfanylmethyl)-N-methylthieno[2,3-d]pyrimidin-4-amine
CID 55045128

Frequently Asked Questions

What is the IUPAC name of 2-(diethylaminomethyl)-N-methylthieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of 2-(diethylaminomethyl)-N-methylthieno[2,3-d]pyrimidin-4-amine (CID 62178753) is 2-(diethylaminomethyl)-N-methylthieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 2-(diethylaminomethyl)-N-methylthieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 2-(diethylaminomethyl)-N-methylthieno[2,3-d]pyrimidin-4-amine is CCN(CC)Cc1nc(NC)c2ccsc2n1.
What is the InChIKey of 2-(diethylaminomethyl)-N-methylthieno[2,3-d]pyrimidin-4-amine?
The InChIKey is YQEXZKYXAILBKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4S/c1-4-16(5-2)8-10-14-11(13-3)9-6-7-17-12(9)15-10/h6-7H,4-5,8H2,1-3H3,(H,13,14,15).
What are the key properties of 2-(diethylaminomethyl)-N-methylthieno[2,3-d]pyrimidin-4-amine?
2-(diethylaminomethyl)-N-methylthieno[2,3-d]pyrimidin-4-amine has a molecular weight of 250.37 g/mol, XLogP of 2.57, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diethylaminomethyl)-N-methylthieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 62178753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).