1-(3-chloro-2-fluorophenyl)-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]methanamine

C16H15ClFN3 — CID 166215420

IUPAC1-(3-chloro-2-fluorophenyl)-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]methanamine
SMILESCc1cccn2c(CNCc3cccc(Cl)c3F)cnc12
InChIInChI=1S/C16H15ClFN3/c1-11-4-3-7-21-13(10-20-16(11)21)9-19-8-12-5-2-6-14(17)15(12)18/h2-7,10,19H,8-9H2,1H3
InChIKeyMHQOVISDXSIRGG-UHFFFAOYSA-N
MW303.77 g/mol
LogP3.73
Rot. Bonds4

About 1-(3-chloro-2-fluorophenyl)-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]methanamine

1-(3-chloro-2-fluorophenyl)-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]methanamine (PubChem CID 166215420) has the molecular formula C16H15ClFN3 and a molecular weight of 303.77 g/mol. Its IUPAC name is 1-(3-chloro-2-fluorophenyl)-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]methanamine.

Molecular Properties

Compound Name1-(3-chloro-2-fluorophenyl)-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]methanamine
PubChem CID166215420
Molecular FormulaC16H15ClFN3
Molecular Weight303.77 g/mol
Exact Mass303.09
IUPAC Name1-(3-chloro-2-fluorophenyl)-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]methanamine
SMILESCc1cccn2c(CNCc3cccc(Cl)c3F)cnc12
InChIInChI=1S/C16H15ClFN3/c1-11-4-3-7-21-13(10-20-16(11)21)9-19-8-12-5-2-6-14(17)15(12)18/h2-7,10,19H,8-9H2,1H3
InChIKeyMHQOVISDXSIRGG-UHFFFAOYSA-N
XLogP3.73
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.77
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]propan-1-amine
CID 115651142
3-(chloromethyl)-8-methylimidazo[1,2-a]pyridine
CID 10726071
1-[(8-methylimidazo[1,2-a]pyridin-3-yl)methylamino]pentan-2-ol
CID 111466797
3-ethyl-1-[(8-methylimidazo[1,2-a]pyridin-3-yl)methylamino]pentan-2-ol
CID 111466759
5-methyl-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1,3-thiazol-2-amine
CID 75521940
4-methyl-2-[[(8-methylimidazo[1,2-a]pyridin-3-yl)methylamino]methyl]pentanoic acid
CID 122127689
3-[[(8-methylimidazo[1,2-a]pyridin-3-yl)methylamino]methyl]cyclohexan-1-ol
CID 111467589
N-[(3-chloro-2-fluorophenyl)methyl]prop-2-yn-1-amine
CID 115695732
N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2-pyridin-3-ylacetamide
CID 91782592
N-[[1-[(3-chloro-2-fluorophenyl)methyl]pyrrol-2-yl]methyl]-2-methylpropan-1-amine
CID 102856743
N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1-[(2S,3S)-2-(1-methylpyrazol-4-yl)oxolan-3-yl]methanamine
CID 97007866
(4-fluorophenyl)-[1-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]azetidin-3-yl]methanone
CID 166361524

Frequently Asked Questions

What is the IUPAC name of 1-(3-chloro-2-fluorophenyl)-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]methanamine?
The IUPAC name of 1-(3-chloro-2-fluorophenyl)-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]methanamine (CID 166215420) is 1-(3-chloro-2-fluorophenyl)-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]methanamine.
What is the SMILES notation for 1-(3-chloro-2-fluorophenyl)-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]methanamine?
The canonical SMILES for 1-(3-chloro-2-fluorophenyl)-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]methanamine is Cc1cccn2c(CNCc3cccc(Cl)c3F)cnc12.
What is the InChIKey of 1-(3-chloro-2-fluorophenyl)-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]methanamine?
The InChIKey is MHQOVISDXSIRGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClFN3/c1-11-4-3-7-21-13(10-20-16(11)21)9-19-8-12-5-2-6-14(17)15(12)18/h2-7,10,19H,8-9H2,1H3.
What are the key properties of 1-(3-chloro-2-fluorophenyl)-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]methanamine?
1-(3-chloro-2-fluorophenyl)-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]methanamine has a molecular weight of 303.77 g/mol, XLogP of 3.73, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chloro-2-fluorophenyl)-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]methanamine is sourced from PubChem (CID 166215420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).