3-amino-5-[[1-(cyclopropylamino)-1-oxopropan-2-yl]amino]-1,2-thiazole-4-carboxamide

C10H15N5O2S — CID 103383966

IUPAC3-amino-5-[[1-(cyclopropylamino)-1-oxopropan-2-yl]amino]-1,2-thiazole-4-carboxamide
SMILESCC(Nc1snc(N)c1C(N)=O)C(=O)NC1CC1
InChIInChI=1S/C10H15N5O2S/c1-4(9(17)14-5-2-3-5)13-10-6(8(12)16)7(11)15-18-10/h4-5,13H,2-3H2,1H3,(H2,11,15)(H2,12,16)(H,14,17)
InChIKeyFSXDAINLKMHENP-UHFFFAOYSA-N
MW269.33 g/mol
LogP-0.10
Rot. Bonds5

About 3-amino-5-[[1-(cyclopropylamino)-1-oxopropan-2-yl]amino]-1,2-thiazole-4-carboxamide

3-amino-5-[[1-(cyclopropylamino)-1-oxopropan-2-yl]amino]-1,2-thiazole-4-carboxamide (PubChem CID 103383966) has the molecular formula C10H15N5O2S and a molecular weight of 269.33 g/mol. Its IUPAC name is 3-amino-5-[[1-(cyclopropylamino)-1-oxopropan-2-yl]amino]-1,2-thiazole-4-carboxamide.

Molecular Properties

Compound Name3-amino-5-[[1-(cyclopropylamino)-1-oxopropan-2-yl]amino]-1,2-thiazole-4-carboxamide
PubChem CID103383966
Molecular FormulaC10H15N5O2S
Molecular Weight269.33 g/mol
Exact Mass269.09
IUPAC Name3-amino-5-[[1-(cyclopropylamino)-1-oxopropan-2-yl]amino]-1,2-thiazole-4-carboxamide
SMILESCC(Nc1snc(N)c1C(N)=O)C(=O)NC1CC1
InChIInChI=1S/C10H15N5O2S/c1-4(9(17)14-5-2-3-5)13-10-6(8(12)16)7(11)15-18-10/h4-5,13H,2-3H2,1H3,(H2,11,15)(H2,12,16)(H,14,17)
InChIKeyFSXDAINLKMHENP-UHFFFAOYSA-N
XLogP-0.10
TPSA123.13 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.33
LogP ≤ 5-0.10
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-amino-5-[[1-(cyclopropylamino)-1-oxopropan-2-yl]amino]-1,2-thiazole-4-carboxamide?
The IUPAC name of 3-amino-5-[[1-(cyclopropylamino)-1-oxopropan-2-yl]amino]-1,2-thiazole-4-carboxamide (CID 103383966) is 3-amino-5-[[1-(cyclopropylamino)-1-oxopropan-2-yl]amino]-1,2-thiazole-4-carboxamide.
What is the SMILES notation for 3-amino-5-[[1-(cyclopropylamino)-1-oxopropan-2-yl]amino]-1,2-thiazole-4-carboxamide?
The canonical SMILES for 3-amino-5-[[1-(cyclopropylamino)-1-oxopropan-2-yl]amino]-1,2-thiazole-4-carboxamide is CC(Nc1snc(N)c1C(N)=O)C(=O)NC1CC1.
What is the InChIKey of 3-amino-5-[[1-(cyclopropylamino)-1-oxopropan-2-yl]amino]-1,2-thiazole-4-carboxamide?
The InChIKey is FSXDAINLKMHENP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5O2S/c1-4(9(17)14-5-2-3-5)13-10-6(8(12)16)7(11)15-18-10/h4-5,13H,2-3H2,1H3,(H2,11,15)(H2,12,16)(H,14,17).
What are the key properties of 3-amino-5-[[1-(cyclopropylamino)-1-oxopropan-2-yl]amino]-1,2-thiazole-4-carboxamide?
3-amino-5-[[1-(cyclopropylamino)-1-oxopropan-2-yl]amino]-1,2-thiazole-4-carboxamide has a molecular weight of 269.33 g/mol, XLogP of -0.10, 5 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-5-[[1-(cyclopropylamino)-1-oxopropan-2-yl]amino]-1,2-thiazole-4-carboxamide is sourced from PubChem (CID 103383966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).