[2-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridin-7-yl]methanamine

C13H13N3S — CID 117135650

IUPAC[2-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridin-7-yl]methanamine
SMILESNCc1ccn2cc(Cc3cccs3)nc2c1
InChIInChI=1S/C13H13N3S/c14-8-10-3-4-16-9-11(15-13(16)6-10)7-12-2-1-5-17-12/h1-6,9H,7-8,14H2
InChIKeyPTBQQZFRLMZAMZ-UHFFFAOYSA-N
MW243.34 g/mol
LogP2.45
Rot. Bonds3

About [2-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridin-7-yl]methanamine

[2-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridin-7-yl]methanamine (PubChem CID 117135650) has the molecular formula C13H13N3S and a molecular weight of 243.34 g/mol. Its IUPAC name is [2-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridin-7-yl]methanamine.

Molecular Properties

Compound Name[2-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridin-7-yl]methanamine
PubChem CID117135650
Molecular FormulaC13H13N3S
Molecular Weight243.34 g/mol
Exact Mass243.08
IUPAC Name[2-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridin-7-yl]methanamine
SMILESNCc1ccn2cc(Cc3cccs3)nc2c1
InChIInChI=1S/C13H13N3S/c14-8-10-3-4-16-9-11(15-13(16)6-10)7-12-2-1-5-17-12/h1-6,9H,7-8,14H2
InChIKeyPTBQQZFRLMZAMZ-UHFFFAOYSA-N
XLogP2.45
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.34
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2-thiophen-2-ylimidazo[1,2-a]pyridin-7-yl)methanamine
CID 79021026
[2-(2-methylpropyl)imidazo[1,2-a]pyridin-7-yl]methanamine
CID 117135250
8-bromo-2-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine
CID 117137871
8-methyl-2-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine
CID 117137867
[1-methyl-2-(thiophen-2-ylmethyl)benzimidazol-5-yl]methanamine
CID 65040104
(2-pyridin-2-ylimidazo[1,2-a]pyridin-7-yl)methanamine
CID 82059883
[6-(thiophen-2-ylmethyl)pyrimidin-4-yl]methanamine
CID 121206379
[2-[(1-methylpiperidin-4-yl)methyl]imidazo[1,2-a]pyridin-7-yl]methanamine
CID 117133868
[2-(pyrrolidin-3-ylmethyl)imidazo[1,2-a]pyridin-7-yl]methanamine
CID 117133738
[3-[(thiophen-2-ylmethylamino)methyl]phenyl]methanamine
CID 115212986
[2-(piperidin-2-ylmethyl)imidazo[1,2-a]pyridin-7-yl]methanamine
CID 117134516
2-benzylimidazo[1,2-a]pyridine-7-carbaldehyde
CID 117134926

Frequently Asked Questions

What is the IUPAC name of [2-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridin-7-yl]methanamine?
The IUPAC name of [2-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridin-7-yl]methanamine (CID 117135650) is [2-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridin-7-yl]methanamine.
What is the SMILES notation for [2-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridin-7-yl]methanamine?
The canonical SMILES for [2-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridin-7-yl]methanamine is NCc1ccn2cc(Cc3cccs3)nc2c1.
What is the InChIKey of [2-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridin-7-yl]methanamine?
The InChIKey is PTBQQZFRLMZAMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3S/c14-8-10-3-4-16-9-11(15-13(16)6-10)7-12-2-1-5-17-12/h1-6,9H,7-8,14H2.
What are the key properties of [2-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridin-7-yl]methanamine?
[2-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridin-7-yl]methanamine has a molecular weight of 243.34 g/mol, XLogP of 2.45, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridin-7-yl]methanamine is sourced from PubChem (CID 117135650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).