N-(2-methoxy-4-pyridinyl)thieno[3,2-d]pyrimidin-4-amine

C12H10N4OS — CID 155595848

IUPACN-(2-methoxy-4-pyridinyl)thieno[3,2-d]pyrimidin-4-amine
SMILESCOc1cc(Nc2ncnc3ccsc23)ccn1
InChIInChI=1S/C12H10N4OS/c1-17-10-6-8(2-4-13-10)16-12-11-9(3-5-18-11)14-7-15-12/h2-7H,1H3,(H,13,14,15,16)
InChIKeyBJDSQQXZQOIFMW-UHFFFAOYSA-N
MW258.31 g/mol
LogP2.84
Rot. Bonds3

About N-(2-methoxy-4-pyridinyl)thieno[3,2-d]pyrimidin-4-amine

N-(2-methoxy-4-pyridinyl)thieno[3,2-d]pyrimidin-4-amine (PubChem CID 155595848) has the molecular formula C12H10N4OS and a molecular weight of 258.31 g/mol. Its IUPAC name is N-(2-methoxy-4-pyridinyl)thieno[3,2-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-(2-methoxy-4-pyridinyl)thieno[3,2-d]pyrimidin-4-amine
PubChem CID155595848
Molecular FormulaC12H10N4OS
Molecular Weight258.31 g/mol
Exact Mass258.06
IUPAC NameN-(2-methoxy-4-pyridinyl)thieno[3,2-d]pyrimidin-4-amine
SMILESCOc1cc(Nc2ncnc3ccsc23)ccn1
InChIInChI=1S/C12H10N4OS/c1-17-10-6-8(2-4-13-10)16-12-11-9(3-5-18-11)14-7-15-12/h2-7H,1H3,(H,13,14,15,16)
InChIKeyBJDSQQXZQOIFMW-UHFFFAOYSA-N
XLogP2.84
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.31
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(3,4-dimethoxyphenyl)thieno[3,2-d]pyrimidin-4-amine;hydrochloride
CID 57422578
3-(thieno[3,2-d]pyrimidin-4-ylamino)benzaldehyde
CID 167084503
1-[3-(thieno[3,2-d]pyrimidin-4-ylamino)phenyl]ethanone
CID 17422025
N-[3-(trifluoromethyl)phenyl]thieno[3,2-d]pyrimidin-4-amine
CID 170560489
N-(5-methyl-1H-pyrazol-3-yl)thieno[3,2-d]pyrimidin-4-amine
CID 18382908
N-[1-(2,5-dimethoxyphenyl)ethyl]thieno[3,2-d]pyrimidin-4-amine
CID 42926398
N-[(1S)-1-(2,5-dimethoxyphenyl)ethyl]thieno[3,2-d]pyrimidin-4-amine
CID 35790358
N-(4-phenylmethoxyphenyl)thieno[3,2-d]pyrimidin-4-amine
CID 22112865
N'-propan-2-yl-N-thieno[3,2-d]pyrimidin-4-ylethane-1,2-diamine
CID 62663575
N-(4-benzylphenyl)thieno[3,2-d]pyrimidin-4-amine;hydrochloride
CID 22112828
N-[1-(4-methoxyphenyl)ethyl]thieno[3,2-d]pyrimidin-4-amine
CID 62048196
6-[4-(chloromethyl)phenyl]-N-(2-methoxy-4-pyridinyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine
CID 69182275

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-4-pyridinyl)thieno[3,2-d]pyrimidin-4-amine?
The IUPAC name of N-(2-methoxy-4-pyridinyl)thieno[3,2-d]pyrimidin-4-amine (CID 155595848) is N-(2-methoxy-4-pyridinyl)thieno[3,2-d]pyrimidin-4-amine.
What is the SMILES notation for N-(2-methoxy-4-pyridinyl)thieno[3,2-d]pyrimidin-4-amine?
The canonical SMILES for N-(2-methoxy-4-pyridinyl)thieno[3,2-d]pyrimidin-4-amine is COc1cc(Nc2ncnc3ccsc23)ccn1.
What is the InChIKey of N-(2-methoxy-4-pyridinyl)thieno[3,2-d]pyrimidin-4-amine?
The InChIKey is BJDSQQXZQOIFMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N4OS/c1-17-10-6-8(2-4-13-10)16-12-11-9(3-5-18-11)14-7-15-12/h2-7H,1H3,(H,13,14,15,16).
What are the key properties of N-(2-methoxy-4-pyridinyl)thieno[3,2-d]pyrimidin-4-amine?
N-(2-methoxy-4-pyridinyl)thieno[3,2-d]pyrimidin-4-amine has a molecular weight of 258.31 g/mol, XLogP of 2.84, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-4-pyridinyl)thieno[3,2-d]pyrimidin-4-amine is sourced from PubChem (CID 155595848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).