2-[2-(dimethylamino)pyrimidin-5-yl]-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine

C17H17N7S — CID 95802748

IUPAC2-[2-(dimethylamino)pyrimidin-5-yl]-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine
SMILESCN(C)c1ncc(-c2nc3cnccn3c2NCc2cccs2)cn1
InChIInChI=1S/C17H17N7S/c1-23(2)17-20-8-12(9-21-17)15-16(19-10-13-4-3-7-25-13)24-6-5-18-11-14(24)22-15/h3-9,11,19H,10H2,1-2H3
InChIKeyIPTACEPROOFHLR-UHFFFAOYSA-N
MW351.44 g/mol
LogP2.93
Rot. Bonds5

About 2-[2-(dimethylamino)pyrimidin-5-yl]-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine

2-[2-(dimethylamino)pyrimidin-5-yl]-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine (PubChem CID 95802748) has the molecular formula C17H17N7S and a molecular weight of 351.44 g/mol. Its IUPAC name is 2-[2-(dimethylamino)pyrimidin-5-yl]-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine.

Molecular Properties

Compound Name2-[2-(dimethylamino)pyrimidin-5-yl]-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine
PubChem CID95802748
Molecular FormulaC17H17N7S
Molecular Weight351.44 g/mol
Exact Mass351.13
IUPAC Name2-[2-(dimethylamino)pyrimidin-5-yl]-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine
SMILESCN(C)c1ncc(-c2nc3cnccn3c2NCc2cccs2)cn1
InChIInChI=1S/C17H17N7S/c1-23(2)17-20-8-12(9-21-17)15-16(19-10-13-4-3-7-25-13)24-6-5-18-11-14(24)22-15/h3-9,11,19H,10H2,1-2H3
InChIKeyIPTACEPROOFHLR-UHFFFAOYSA-N
XLogP2.93
TPSA71.24 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.44
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 2-[2-(dimethylamino)pyrimidin-5-yl]-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-pyridin-3-yl-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine
CID 46952213
4-[3-(thiophen-2-ylmethylamino)imidazo[1,2-a]pyrazin-2-yl]benzene-1,2-diol
CID 135674296
2-(5-methylthiophen-2-yl)-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine
CID 95802645
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[2-(dimethylamino)pyrimidin-5-yl]imidazo[1,2-a]pyrazin-3-amine
CID 16668578
N-(furan-2-ylmethyl)-2-thiophen-2-ylimidazo[1,2-a]pyrazin-3-amine
CID 95802609
N-[(methylideneamino)methyl]-2-phenylimidazo[1,2-a]pyrazin-3-amine
CID 143363755
2-(dimethylamino)-N-(thiophen-2-ylmethyl)pyrimidine-5-carboxamide
CID 53299092
N-tert-butyl-2-[5-(2-thiophen-2-ylethynyl)thiophen-2-yl]imidazo[1,2-a]pyrazin-3-amine;hydrochloride
CID 69322196
2-(furan-2-yl)-N-[(4-methoxyphenyl)methyl]imidazo[1,2-a]pyrazin-3-amine
CID 16668400
2-[3-[(4-fluorophenyl)methylamino]imidazo[1,2-a]pyrazin-2-yl]phenol
CID 135674314
N-[(4-fluorophenyl)methyl]-2-(furan-2-yl)imidazo[1,2-a]pyrazin-3-amine
CID 16674805
4-N-ethyl-6-imidazol-1-yl-2-N-(thiophen-2-ylmethyl)-1,3,5-triazine-2,4-diamine
CID 80770959

Frequently Asked Questions

What is the IUPAC name of 2-[2-(dimethylamino)pyrimidin-5-yl]-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine?
The IUPAC name of 2-[2-(dimethylamino)pyrimidin-5-yl]-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine (CID 95802748) is 2-[2-(dimethylamino)pyrimidin-5-yl]-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine.
What is the SMILES notation for 2-[2-(dimethylamino)pyrimidin-5-yl]-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine?
The canonical SMILES for 2-[2-(dimethylamino)pyrimidin-5-yl]-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine is CN(C)c1ncc(-c2nc3cnccn3c2NCc2cccs2)cn1.
What is the InChIKey of 2-[2-(dimethylamino)pyrimidin-5-yl]-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine?
The InChIKey is IPTACEPROOFHLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N7S/c1-23(2)17-20-8-12(9-21-17)15-16(19-10-13-4-3-7-25-13)24-6-5-18-11-14(24)22-15/h3-9,11,19H,10H2,1-2H3.
What are the key properties of 2-[2-(dimethylamino)pyrimidin-5-yl]-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine?
2-[2-(dimethylamino)pyrimidin-5-yl]-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine has a molecular weight of 351.44 g/mol, XLogP of 2.93, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(dimethylamino)pyrimidin-5-yl]-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine is sourced from PubChem (CID 95802748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).