3-(aminomethyl)-N-[(2-fluorophenyl)methyl]-N-methylimidazo[1,2-a]pyridin-2-amine

C16H17FN4 — CID 61412739

IUPAC3-(aminomethyl)-N-[(2-fluorophenyl)methyl]-N-methylimidazo[1,2-a]pyridin-2-amine
SMILESCN(Cc1ccccc1F)c1nc2ccccn2c1CN
InChIInChI=1S/C16H17FN4/c1-20(11-12-6-2-3-7-13(12)17)16-14(10-18)21-9-5-4-8-15(21)19-16/h2-9H,10-11,18H2,1H3
InChIKeyCYHJTTOEUQPMCF-UHFFFAOYSA-N
MW284.34 g/mol
LogP2.57
Rot. Bonds4

About 3-(aminomethyl)-N-[(2-fluorophenyl)methyl]-N-methylimidazo[1,2-a]pyridin-2-amine

3-(aminomethyl)-N-[(2-fluorophenyl)methyl]-N-methylimidazo[1,2-a]pyridin-2-amine (PubChem CID 61412739) has the molecular formula C16H17FN4 and a molecular weight of 284.34 g/mol. Its IUPAC name is 3-(aminomethyl)-N-[(2-fluorophenyl)methyl]-N-methylimidazo[1,2-a]pyridin-2-amine.

Molecular Properties

Compound Name3-(aminomethyl)-N-[(2-fluorophenyl)methyl]-N-methylimidazo[1,2-a]pyridin-2-amine
PubChem CID61412739
Molecular FormulaC16H17FN4
Molecular Weight284.34 g/mol
Exact Mass284.14
IUPAC Name3-(aminomethyl)-N-[(2-fluorophenyl)methyl]-N-methylimidazo[1,2-a]pyridin-2-amine
SMILESCN(Cc1ccccc1F)c1nc2ccccn2c1CN
InChIInChI=1S/C16H17FN4/c1-20(11-12-6-2-3-7-13(12)17)16-14(10-18)21-9-5-4-8-15(21)19-16/h2-9H,10-11,18H2,1H3
InChIKeyCYHJTTOEUQPMCF-UHFFFAOYSA-N
XLogP2.57
TPSA46.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.34
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-N-[(2-fluorophenyl)methyl]-N-methylimidazo[1,2-a]pyridin-2-amine?
The IUPAC name of 3-(aminomethyl)-N-[(2-fluorophenyl)methyl]-N-methylimidazo[1,2-a]pyridin-2-amine (CID 61412739) is 3-(aminomethyl)-N-[(2-fluorophenyl)methyl]-N-methylimidazo[1,2-a]pyridin-2-amine.
What is the SMILES notation for 3-(aminomethyl)-N-[(2-fluorophenyl)methyl]-N-methylimidazo[1,2-a]pyridin-2-amine?
The canonical SMILES for 3-(aminomethyl)-N-[(2-fluorophenyl)methyl]-N-methylimidazo[1,2-a]pyridin-2-amine is CN(Cc1ccccc1F)c1nc2ccccn2c1CN.
What is the InChIKey of 3-(aminomethyl)-N-[(2-fluorophenyl)methyl]-N-methylimidazo[1,2-a]pyridin-2-amine?
The InChIKey is CYHJTTOEUQPMCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN4/c1-20(11-12-6-2-3-7-13(12)17)16-14(10-18)21-9-5-4-8-15(21)19-16/h2-9H,10-11,18H2,1H3.
What are the key properties of 3-(aminomethyl)-N-[(2-fluorophenyl)methyl]-N-methylimidazo[1,2-a]pyridin-2-amine?
3-(aminomethyl)-N-[(2-fluorophenyl)methyl]-N-methylimidazo[1,2-a]pyridin-2-amine has a molecular weight of 284.34 g/mol, XLogP of 2.57, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-N-[(2-fluorophenyl)methyl]-N-methylimidazo[1,2-a]pyridin-2-amine is sourced from PubChem (CID 61412739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).