3-methoxy-2-N-thieno[2,3-d]pyrimidin-4-ylpropane-1,2-diamine

C10H14N4OS — CID 106182134

IUPAC3-methoxy-2-N-thieno[2,3-d]pyrimidin-4-ylpropane-1,2-diamine
SMILESCOCC(CN)Nc1ncnc2sccc12
InChIInChI=1S/C10H14N4OS/c1-15-5-7(4-11)14-9-8-2-3-16-10(8)13-6-12-9/h2-3,6-7H,4-5,11H2,1H3,(H,12,13,14)
InChIKeyLLUCSSWYKRDEHV-UHFFFAOYSA-N
MW238.32 g/mol
LogP1.08
Rot. Bonds5

About 3-methoxy-2-N-thieno[2,3-d]pyrimidin-4-ylpropane-1,2-diamine

3-methoxy-2-N-thieno[2,3-d]pyrimidin-4-ylpropane-1,2-diamine (PubChem CID 106182134) has the molecular formula C10H14N4OS and a molecular weight of 238.32 g/mol. Its IUPAC name is 3-methoxy-2-N-thieno[2,3-d]pyrimidin-4-ylpropane-1,2-diamine.

Molecular Properties

Compound Name3-methoxy-2-N-thieno[2,3-d]pyrimidin-4-ylpropane-1,2-diamine
PubChem CID106182134
Molecular FormulaC10H14N4OS
Molecular Weight238.32 g/mol
Exact Mass238.09
IUPAC Name3-methoxy-2-N-thieno[2,3-d]pyrimidin-4-ylpropane-1,2-diamine
SMILESCOCC(CN)Nc1ncnc2sccc12
InChIInChI=1S/C10H14N4OS/c1-15-5-7(4-11)14-9-8-2-3-16-10(8)13-6-12-9/h2-3,6-7H,4-5,11H2,1H3,(H,12,13,14)
InChIKeyLLUCSSWYKRDEHV-UHFFFAOYSA-N
XLogP1.08
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.32
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-N-thieno[2,3-d]pyrimidin-4-ylpropane-1,2-diamine
CID 63732565
N-(4-methoxybutan-2-yl)thieno[2,3-d]pyrimidin-4-amine
CID 62735152
N-[1-(furan-2-yl)-2-methoxyethyl]thieno[2,3-d]pyrimidin-4-amine
CID 133336576
4-methoxy-3-N-(6-methylthieno[2,3-d]pyrimidin-4-yl)butane-1,3-diamine
CID 106154672
N-hexan-2-ylthieno[2,3-d]pyrimidin-4-amine
CID 13038322
N-[(1S)-1-(4-aminophenyl)ethyl]thieno[2,3-d]pyrimidin-4-amine
CID 155460392
3-[(2-aminothieno[2,3-d]pyrimidin-4-yl)amino]-4-methoxybutan-1-ol
CID 106163052
N'-thieno[2,3-d]pyrimidin-4-ylethane-1,2-diamine;dihydrochloride
CID 122163962
(2R)-3-methyl-2-(thieno[2,3-d]pyrimidin-4-ylamino)butanoic acid
CID 93263493
N-(2-methoxy-2-methylpropyl)thieno[2,3-d]pyrimidin-4-amine
CID 115658497
N-[1-(2-methoxyphenyl)propan-2-yl]thieno[2,3-d]pyrimidin-4-amine
CID 67604920
N-[(1S)-1-(4-methylphenyl)ethyl]thieno[2,3-d]pyrimidin-4-amine
CID 155460692

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-2-N-thieno[2,3-d]pyrimidin-4-ylpropane-1,2-diamine?
The IUPAC name of 3-methoxy-2-N-thieno[2,3-d]pyrimidin-4-ylpropane-1,2-diamine (CID 106182134) is 3-methoxy-2-N-thieno[2,3-d]pyrimidin-4-ylpropane-1,2-diamine.
What is the SMILES notation for 3-methoxy-2-N-thieno[2,3-d]pyrimidin-4-ylpropane-1,2-diamine?
The canonical SMILES for 3-methoxy-2-N-thieno[2,3-d]pyrimidin-4-ylpropane-1,2-diamine is COCC(CN)Nc1ncnc2sccc12.
What is the InChIKey of 3-methoxy-2-N-thieno[2,3-d]pyrimidin-4-ylpropane-1,2-diamine?
The InChIKey is LLUCSSWYKRDEHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4OS/c1-15-5-7(4-11)14-9-8-2-3-16-10(8)13-6-12-9/h2-3,6-7H,4-5,11H2,1H3,(H,12,13,14).
What are the key properties of 3-methoxy-2-N-thieno[2,3-d]pyrimidin-4-ylpropane-1,2-diamine?
3-methoxy-2-N-thieno[2,3-d]pyrimidin-4-ylpropane-1,2-diamine has a molecular weight of 238.32 g/mol, XLogP of 1.08, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2-N-thieno[2,3-d]pyrimidin-4-ylpropane-1,2-diamine is sourced from PubChem (CID 106182134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).