N-(6-amino-1-methyl-2,4-dioxopyrimidin-5-yl)thiophene-2-carboxamide

C10H10N4O3S — CID 42281640

IUPACN-(6-amino-1-methyl-2,4-dioxopyrimidin-5-yl)thiophene-2-carboxamide
SMILESCn1c(N)c(NC(=O)c2cccs2)c(=O)[nH]c1=O
InChIInChI=1S/C10H10N4O3S/c1-14-7(11)6(9(16)13-10(14)17)12-8(15)5-3-2-4-18-5/h2-4H,11H2,1H3,(H,12,15)(H,13,16,17)
InChIKeyZYGJTXFPJCHMBU-UHFFFAOYSA-N
MW266.28 g/mol
LogP-0.03
Rot. Bonds2

About N-(6-amino-1-methyl-2,4-dioxopyrimidin-5-yl)thiophene-2-carboxamide

N-(6-amino-1-methyl-2,4-dioxopyrimidin-5-yl)thiophene-2-carboxamide (PubChem CID 42281640) has the molecular formula C10H10N4O3S and a molecular weight of 266.28 g/mol. Its IUPAC name is N-(6-amino-1-methyl-2,4-dioxopyrimidin-5-yl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(6-amino-1-methyl-2,4-dioxopyrimidin-5-yl)thiophene-2-carboxamide
PubChem CID42281640
Molecular FormulaC10H10N4O3S
Molecular Weight266.28 g/mol
Exact Mass266.05
IUPAC NameN-(6-amino-1-methyl-2,4-dioxopyrimidin-5-yl)thiophene-2-carboxamide
SMILESCn1c(N)c(NC(=O)c2cccs2)c(=O)[nH]c1=O
InChIInChI=1S/C10H10N4O3S/c1-14-7(11)6(9(16)13-10(14)17)12-8(15)5-3-2-4-18-5/h2-4H,11H2,1H3,(H,12,15)(H,13,16,17)
InChIKeyZYGJTXFPJCHMBU-UHFFFAOYSA-N
XLogP-0.03
TPSA109.98 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.28
LogP ≤ 5-0.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(6-amino-1-methyl-2,4-dioxopyrimidin-5-yl)thiophene-2-carboxamide?
The IUPAC name of N-(6-amino-1-methyl-2,4-dioxopyrimidin-5-yl)thiophene-2-carboxamide (CID 42281640) is N-(6-amino-1-methyl-2,4-dioxopyrimidin-5-yl)thiophene-2-carboxamide.
What is the SMILES notation for N-(6-amino-1-methyl-2,4-dioxopyrimidin-5-yl)thiophene-2-carboxamide?
The canonical SMILES for N-(6-amino-1-methyl-2,4-dioxopyrimidin-5-yl)thiophene-2-carboxamide is Cn1c(N)c(NC(=O)c2cccs2)c(=O)[nH]c1=O.
What is the InChIKey of N-(6-amino-1-methyl-2,4-dioxopyrimidin-5-yl)thiophene-2-carboxamide?
The InChIKey is ZYGJTXFPJCHMBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O3S/c1-14-7(11)6(9(16)13-10(14)17)12-8(15)5-3-2-4-18-5/h2-4H,11H2,1H3,(H,12,15)(H,13,16,17).
What are the key properties of N-(6-amino-1-methyl-2,4-dioxopyrimidin-5-yl)thiophene-2-carboxamide?
N-(6-amino-1-methyl-2,4-dioxopyrimidin-5-yl)thiophene-2-carboxamide has a molecular weight of 266.28 g/mol, XLogP of -0.03, 2 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-amino-1-methyl-2,4-dioxopyrimidin-5-yl)thiophene-2-carboxamide is sourced from PubChem (CID 42281640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).