N-(2-furylmethyl)-4-(2-methylimidazo[1,2-a]pyrimidin-3-yl)-1,3-thiazol-2-amine

C15H13N5OS — CID 2901742

IUPACN-(furan-2-ylmethyl)-4-(2-methylimidazo[1,2-a]pyrimidin-3-yl)-1,3-thiazol-2-amine
SMILESCC1=C(N2C=CC=NC2=N1)C3=CSC(=N3)NCC4=CC=CO4
InChIInChI=1S/C15H13N5OS/c1-10-13(20-6-3-5-16-14(20)18-10)12-9-22-15(19-12)17-8-11-4-2-7-21-11/h2-7,9H,8H2,1H3,(H,17,19)
InChIKeyVLHRIYMAVVINPX-UHFFFAOYSA-N
MW311.40 g/mol
LogP3.20
Rot. Bonds4

About N-(2-furylmethyl)-4-(2-methylimidazo[1,2-a]pyrimidin-3-yl)-1,3-thiazol-2-amine

N-(2-furylmethyl)-4-(2-methylimidazo[1,2-a]pyrimidin-3-yl)-1,3-thiazol-2-amine (PubChem CID 2901742) has the molecular formula C15H13N5OS and a molecular weight of 311.40 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-4-(2-methylimidazo[1,2-a]pyrimidin-3-yl)-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(2-furylmethyl)-4-(2-methylimidazo[1,2-a]pyrimidin-3-yl)-1,3-thiazol-2-amine
PubChem CID2901742
Molecular FormulaC15H13N5OS
Molecular Weight311.40 g/mol
Exact Mass311.08
IUPAC NameN-(furan-2-ylmethyl)-4-(2-methylimidazo[1,2-a]pyrimidin-3-yl)-1,3-thiazol-2-amine
SMILESCC1=C(N2C=CC=NC2=N1)C3=CSC(=N3)NCC4=CC=CO4
InChIInChI=1S/C15H13N5OS/c1-10-13(20-6-3-5-16-14(20)18-10)12-9-22-15(19-12)17-8-11-4-2-7-21-11/h2-7,9H,8H2,1H3,(H,17,19)
InChIKeyVLHRIYMAVVINPX-UHFFFAOYSA-N
XLogP3.20
TPSA96.50 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity387

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.40
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(furan-2-yl)-5-N-(thiophen-2-ylmethyl)-[1,3]thiazolo[5,4-d]pyrimidine-5,7-diamine
CID 145436760
2-(furan-2-yl)-5-N-(2-pyridin-3-ylethyl)-[1,3]thiazolo[5,4-d]pyrimidine-5,7-diamine
CID 145436763
2-(furan-2-yl)-5-N-(thiophen-3-ylmethyl)-[1,3]thiazolo[5,4-d]pyrimidine-5,7-diamine
CID 145436764
2-(furan-2-yl)-5-N-(2-thiophen-2-ylethyl)-[1,3]thiazolo[5,4-d]pyrimidine-5,7-diamine
CID 145436765
2-(furan-2-yl)-5-N-(pyridin-2-ylmethyl)-[1,3]thiazolo[5,4-d]pyrimidine-5,7-diamine
CID 145436766
2-(furan-2-yl)-5-N-(pyridin-3-ylmethyl)-[1,3]thiazolo[5,4-d]pyrimidine-5,7-diamine
CID 145436767
2-(furan-2-yl)-5-N-(furan-2-ylmethyl)-[1,3]thiazolo[5,4-d]pyrimidine-5,7-diamine
CID 145436769
2-(furan-2-yl)-5-N-propyl-[1,3]thiazolo[5,4-d]pyrimidine-5,7-diamine
CID 134151346
5-N-butyl-2-(furan-2-yl)-[1,3]thiazolo[5,4-d]pyrimidine-5,7-diamine
CID 134157761
2-(furan-2-yl)-5-N-(pyrazin-2-ylmethyl)-[1,3]thiazolo[5,4-d]pyrimidine-5,7-diamine
CID 145436761
2-(furan-2-yl)-5-N-(pyridin-4-ylmethyl)-[1,3]thiazolo[5,4-d]pyrimidine-5,7-diamine
CID 145971923
4-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(furan-2-ylmethyl)-1,3-thiazol-2-amine
CID 646758

Frequently Asked Questions

What is the IUPAC name of N-(2-furylmethyl)-4-(2-methylimidazo[1,2-a]pyrimidin-3-yl)-1,3-thiazol-2-amine?
The IUPAC name of N-(2-furylmethyl)-4-(2-methylimidazo[1,2-a]pyrimidin-3-yl)-1,3-thiazol-2-amine (CID 2901742) is N-(furan-2-ylmethyl)-4-(2-methylimidazo[1,2-a]pyrimidin-3-yl)-1,3-thiazol-2-amine.
What is the SMILES notation for N-(2-furylmethyl)-4-(2-methylimidazo[1,2-a]pyrimidin-3-yl)-1,3-thiazol-2-amine?
The canonical SMILES for N-(2-furylmethyl)-4-(2-methylimidazo[1,2-a]pyrimidin-3-yl)-1,3-thiazol-2-amine is CC1=C(N2C=CC=NC2=N1)C3=CSC(=N3)NCC4=CC=CO4.
What is the InChIKey of N-(2-furylmethyl)-4-(2-methylimidazo[1,2-a]pyrimidin-3-yl)-1,3-thiazol-2-amine?
The InChIKey is VLHRIYMAVVINPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N5OS/c1-10-13(20-6-3-5-16-14(20)18-10)12-9-22-15(19-12)17-8-11-4-2-7-21-11/h2-7,9H,8H2,1H3,(H,17,19).
What are the key properties of N-(2-furylmethyl)-4-(2-methylimidazo[1,2-a]pyrimidin-3-yl)-1,3-thiazol-2-amine?
N-(2-furylmethyl)-4-(2-methylimidazo[1,2-a]pyrimidin-3-yl)-1,3-thiazol-2-amine has a molecular weight of 311.40 g/mol, XLogP of 3.20, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-furylmethyl)-4-(2-methylimidazo[1,2-a]pyrimidin-3-yl)-1,3-thiazol-2-amine is sourced from PubChem (CID 2901742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).