2-[2-(methylamino)ethyl]-7,8-dihydro-5H-thiopyrano[4,3-d]pyrimidin-4-amine

C10H16N4S — CID 105482386

IUPAC2-[2-(methylamino)ethyl]-7,8-dihydro-5H-thiopyrano[4,3-d]pyrimidin-4-amine
SMILESCNCCc1nc(N)c2c(n1)CCSC2
InChIInChI=1S/C10H16N4S/c1-12-4-2-9-13-8-3-5-15-6-7(8)10(11)14-9/h12H,2-6H2,1H3,(H2,11,13,14)
InChIKeyDCYXVFZNDHARCF-UHFFFAOYSA-N
MW224.33 g/mol
LogP0.61
Rot. Bonds3

About 2-[2-(methylamino)ethyl]-7,8-dihydro-5H-thiopyrano[4,3-d]pyrimidin-4-amine

2-[2-(methylamino)ethyl]-7,8-dihydro-5H-thiopyrano[4,3-d]pyrimidin-4-amine (PubChem CID 105482386) has the molecular formula C10H16N4S and a molecular weight of 224.33 g/mol. Its IUPAC name is 2-[2-(methylamino)ethyl]-7,8-dihydro-5H-thiopyrano[4,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-[2-(methylamino)ethyl]-7,8-dihydro-5H-thiopyrano[4,3-d]pyrimidin-4-amine
PubChem CID105482386
Molecular FormulaC10H16N4S
Molecular Weight224.33 g/mol
Exact Mass224.11
IUPAC Name2-[2-(methylamino)ethyl]-7,8-dihydro-5H-thiopyrano[4,3-d]pyrimidin-4-amine
SMILESCNCCc1nc(N)c2c(n1)CCSC2
InChIInChI=1S/C10H16N4S/c1-12-4-2-9-13-8-3-5-15-6-7(8)10(11)14-9/h12H,2-6H2,1H3,(H2,11,13,14)
InChIKeyDCYXVFZNDHARCF-UHFFFAOYSA-N
XLogP0.61
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.33
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[2-(methylamino)ethyl]-7,8-dihydro-5H-thiopyrano[4,3-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-[2-(methylamino)ethyl]-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-amine
CID 105476582
2-[1-(methylamino)ethyl]-7,8-dihydro-5H-thiopyrano[4,3-d]pyrimidin-4-amine
CID 105482388
2-(methylaminomethyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
CID 105450171
2-chloro-7,8-dihydro-5H-thiopyrano[4,3-d]pyrimidin-4-amine
CID 105454023
2-[2-(methylamino)propyl]-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
CID 105482392
2-(3-methylbutyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
CID 83191076
1-(4-amino-7,8-dihydro-5H-thiopyrano[4,3-d]pyrimidin-2-yl)ethanone
CID 105463163
2-ethyl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
CID 83190972
2-(methoxymethyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
CID 83191177
2-[2-(methylamino)propyl]-5,6,7,8-tetrahydroquinazolin-4-amine
CID 105476585
2-methyl-5,6,8,9-tetrahydrothiepino[4,5-d]pyrimidin-4-amine
CID 83871652
2-[(2-methyl-1,3-thiazol-4-yl)methyl]-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
CID 83191173

Frequently Asked Questions

What is the IUPAC name of 2-[2-(methylamino)ethyl]-7,8-dihydro-5H-thiopyrano[4,3-d]pyrimidin-4-amine?
The IUPAC name of 2-[2-(methylamino)ethyl]-7,8-dihydro-5H-thiopyrano[4,3-d]pyrimidin-4-amine (CID 105482386) is 2-[2-(methylamino)ethyl]-7,8-dihydro-5H-thiopyrano[4,3-d]pyrimidin-4-amine.
What is the SMILES notation for 2-[2-(methylamino)ethyl]-7,8-dihydro-5H-thiopyrano[4,3-d]pyrimidin-4-amine?
The canonical SMILES for 2-[2-(methylamino)ethyl]-7,8-dihydro-5H-thiopyrano[4,3-d]pyrimidin-4-amine is CNCCc1nc(N)c2c(n1)CCSC2.
What is the InChIKey of 2-[2-(methylamino)ethyl]-7,8-dihydro-5H-thiopyrano[4,3-d]pyrimidin-4-amine?
The InChIKey is DCYXVFZNDHARCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4S/c1-12-4-2-9-13-8-3-5-15-6-7(8)10(11)14-9/h12H,2-6H2,1H3,(H2,11,13,14).
What are the key properties of 2-[2-(methylamino)ethyl]-7,8-dihydro-5H-thiopyrano[4,3-d]pyrimidin-4-amine?
2-[2-(methylamino)ethyl]-7,8-dihydro-5H-thiopyrano[4,3-d]pyrimidin-4-amine has a molecular weight of 224.33 g/mol, XLogP of 0.61, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(methylamino)ethyl]-7,8-dihydro-5H-thiopyrano[4,3-d]pyrimidin-4-amine is sourced from PubChem (CID 105482386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).