6-methyl-N-(3-methyl-2-morpholin-4-ylbutyl)thieno[2,3-d]pyrimidin-4-amine

C16H24N4OS — CID 133408697

IUPAC6-methyl-N-(3-methyl-2-morpholin-4-ylbutyl)thieno[2,3-d]pyrimidin-4-amine
SMILESCc1cc2c(NCC(C(C)C)N3CCOCC3)ncnc2s1
InChIInChI=1S/C16H24N4OS/c1-11(2)14(20-4-6-21-7-5-20)9-17-15-13-8-12(3)22-16(13)19-10-18-15/h8,10-11,14H,4-7,9H2,1-3H3,(H,17,18,19)
InChIKeyRRAFRSSMKTWOGG-UHFFFAOYSA-N
MW320.46 g/mol
LogP2.77
Rot. Bonds5

About 6-methyl-N-(3-methyl-2-morpholin-4-ylbutyl)thieno[2,3-d]pyrimidin-4-amine

6-methyl-N-(3-methyl-2-morpholin-4-ylbutyl)thieno[2,3-d]pyrimidin-4-amine (PubChem CID 133408697) has the molecular formula C16H24N4OS and a molecular weight of 320.46 g/mol. Its IUPAC name is 6-methyl-N-(3-methyl-2-morpholin-4-ylbutyl)thieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name6-methyl-N-(3-methyl-2-morpholin-4-ylbutyl)thieno[2,3-d]pyrimidin-4-amine
PubChem CID133408697
Molecular FormulaC16H24N4OS
Molecular Weight320.46 g/mol
Exact Mass320.17
IUPAC Name6-methyl-N-(3-methyl-2-morpholin-4-ylbutyl)thieno[2,3-d]pyrimidin-4-amine
SMILESCc1cc2c(NCC(C(C)C)N3CCOCC3)ncnc2s1
InChIInChI=1S/C16H24N4OS/c1-11(2)14(20-4-6-21-7-5-20)9-17-15-13-8-12(3)22-16(13)19-10-18-15/h8,10-11,14H,4-7,9H2,1-3H3,(H,17,18,19)
InChIKeyRRAFRSSMKTWOGG-UHFFFAOYSA-N
XLogP2.77
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.46
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-(3-methyl-2-morpholin-4-ylbutyl)thieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of 6-methyl-N-(3-methyl-2-morpholin-4-ylbutyl)thieno[2,3-d]pyrimidin-4-amine (CID 133408697) is 6-methyl-N-(3-methyl-2-morpholin-4-ylbutyl)thieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 6-methyl-N-(3-methyl-2-morpholin-4-ylbutyl)thieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 6-methyl-N-(3-methyl-2-morpholin-4-ylbutyl)thieno[2,3-d]pyrimidin-4-amine is Cc1cc2c(NCC(C(C)C)N3CCOCC3)ncnc2s1.
What is the InChIKey of 6-methyl-N-(3-methyl-2-morpholin-4-ylbutyl)thieno[2,3-d]pyrimidin-4-amine?
The InChIKey is RRAFRSSMKTWOGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4OS/c1-11(2)14(20-4-6-21-7-5-20)9-17-15-13-8-12(3)22-16(13)19-10-18-15/h8,10-11,14H,4-7,9H2,1-3H3,(H,17,18,19).
What are the key properties of 6-methyl-N-(3-methyl-2-morpholin-4-ylbutyl)thieno[2,3-d]pyrimidin-4-amine?
6-methyl-N-(3-methyl-2-morpholin-4-ylbutyl)thieno[2,3-d]pyrimidin-4-amine has a molecular weight of 320.46 g/mol, XLogP of 2.77, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-(3-methyl-2-morpholin-4-ylbutyl)thieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 133408697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).