N-[3-(2-aminoethoxy)phenyl]-6-methylthieno[2,3-d]pyrimidin-4-amine

C15H16N4OS — CID 63616720

IUPACN-[3-(2-aminoethoxy)phenyl]-6-methylthieno[2,3-d]pyrimidin-4-amine
SMILESCc1cc2c(Nc3cccc(OCCN)c3)ncnc2s1
InChIInChI=1S/C15H16N4OS/c1-10-7-13-14(17-9-18-15(13)21-10)19-11-3-2-4-12(8-11)20-6-5-16/h2-4,7-9H,5-6,16H2,1H3,(H,17,18,19)
InChIKeySEGDUQDVITXOQG-UHFFFAOYSA-N
MW300.39 g/mol
LogP3.08
Rot. Bonds5

About N-[3-(2-aminoethoxy)phenyl]-6-methylthieno[2,3-d]pyrimidin-4-amine

N-[3-(2-aminoethoxy)phenyl]-6-methylthieno[2,3-d]pyrimidin-4-amine (PubChem CID 63616720) has the molecular formula C15H16N4OS and a molecular weight of 300.39 g/mol. Its IUPAC name is N-[3-(2-aminoethoxy)phenyl]-6-methylthieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-[3-(2-aminoethoxy)phenyl]-6-methylthieno[2,3-d]pyrimidin-4-amine
PubChem CID63616720
Molecular FormulaC15H16N4OS
Molecular Weight300.39 g/mol
Exact Mass300.10
IUPAC NameN-[3-(2-aminoethoxy)phenyl]-6-methylthieno[2,3-d]pyrimidin-4-amine
SMILESCc1cc2c(Nc3cccc(OCCN)c3)ncnc2s1
InChIInChI=1S/C15H16N4OS/c1-10-7-13-14(17-9-18-15(13)21-10)19-11-3-2-4-12(8-11)20-6-5-16/h2-4,7-9H,5-6,16H2,1H3,(H,17,18,19)
InChIKeySEGDUQDVITXOQG-UHFFFAOYSA-N
XLogP3.08
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.39
LogP ≤ 53.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

6-methyl-N-phenylthieno[2,3-d]pyrimidin-4-amine;hydrochloride
CID 2974524
N-[3-(2-aminoethoxy)phenyl]-3-bromo-5-methylpyridin-2-amine
CID 105367304
2-chloro-N-(3-ethoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine
CID 103321082
N-[3-(2-aminoethoxy)phenyl]-4,6-dimethylpyrimidin-2-amine
CID 63121057
N-(3-chloro-4-methylphenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine
CID 4288325
2-N,2-N-dimethyl-5-N-(6-methylthieno[2,3-d]pyrimidin-4-yl)pyridine-2,5-diamine
CID 133408655
N-[3-(2-aminoethoxy)phenyl]phthalazin-1-amine
CID 63121028
N-[3-(2-aminoethoxy)phenyl]-5,6-dimethyl-1,2,4-triazin-3-amine
CID 114787066
N-[4-(2-chloroethyl)phenyl]-6-methylthieno[2,3-d]pyrimidin-4-amine
CID 65027620
N-[2-(4-methoxyphenoxy)ethyl]-6-methylthieno[2,3-d]pyrimidin-4-amine
CID 133408034
2-methyl-4-[(6-methylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acid
CID 63617886
4-methoxy-3-N-(6-methylthieno[2,3-d]pyrimidin-4-yl)butane-1,3-diamine
CID 106154672

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-aminoethoxy)phenyl]-6-methylthieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of N-[3-(2-aminoethoxy)phenyl]-6-methylthieno[2,3-d]pyrimidin-4-amine (CID 63616720) is N-[3-(2-aminoethoxy)phenyl]-6-methylthieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for N-[3-(2-aminoethoxy)phenyl]-6-methylthieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for N-[3-(2-aminoethoxy)phenyl]-6-methylthieno[2,3-d]pyrimidin-4-amine is Cc1cc2c(Nc3cccc(OCCN)c3)ncnc2s1.
What is the InChIKey of N-[3-(2-aminoethoxy)phenyl]-6-methylthieno[2,3-d]pyrimidin-4-amine?
The InChIKey is SEGDUQDVITXOQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4OS/c1-10-7-13-14(17-9-18-15(13)21-10)19-11-3-2-4-12(8-11)20-6-5-16/h2-4,7-9H,5-6,16H2,1H3,(H,17,18,19).
What are the key properties of N-[3-(2-aminoethoxy)phenyl]-6-methylthieno[2,3-d]pyrimidin-4-amine?
N-[3-(2-aminoethoxy)phenyl]-6-methylthieno[2,3-d]pyrimidin-4-amine has a molecular weight of 300.39 g/mol, XLogP of 3.08, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-aminoethoxy)phenyl]-6-methylthieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 63616720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).