6-chloro-2-[(5-methylimidazo[1,2-a]pyridin-2-yl)methylamino]quinoline-4-carbonitrile

C19H14ClN5 — CID 133309480

IUPAC6-chloro-2-[(5-methylimidazo[1,2-a]pyridin-2-yl)methylamino]quinoline-4-carbonitrile
SMILESCc1cccc2nc(CNc3cc(C#N)c4cc(Cl)ccc4n3)cn12
InChIInChI=1S/C19H14ClN5/c1-12-3-2-4-19-23-15(11-25(12)19)10-22-18-7-13(9-21)16-8-14(20)5-6-17(16)24-18/h2-8,11H,10H2,1H3,(H,22,24)
InChIKeyCFNAMULYHOJVHS-UHFFFAOYSA-N
MW347.81 g/mol
LogP4.33
Rot. Bonds3

About 6-chloro-2-[(5-methylimidazo[1,2-a]pyridin-2-yl)methylamino]quinoline-4-carbonitrile

6-chloro-2-[(5-methylimidazo[1,2-a]pyridin-2-yl)methylamino]quinoline-4-carbonitrile (PubChem CID 133309480) has the molecular formula C19H14ClN5 and a molecular weight of 347.81 g/mol. Its IUPAC name is 6-chloro-2-[(5-methylimidazo[1,2-a]pyridin-2-yl)methylamino]quinoline-4-carbonitrile.

Molecular Properties

Compound Name6-chloro-2-[(5-methylimidazo[1,2-a]pyridin-2-yl)methylamino]quinoline-4-carbonitrile
PubChem CID133309480
Molecular FormulaC19H14ClN5
Molecular Weight347.81 g/mol
Exact Mass347.09
IUPAC Name6-chloro-2-[(5-methylimidazo[1,2-a]pyridin-2-yl)methylamino]quinoline-4-carbonitrile
SMILESCc1cccc2nc(CNc3cc(C#N)c4cc(Cl)ccc4n3)cn12
InChIInChI=1S/C19H14ClN5/c1-12-3-2-4-19-23-15(11-25(12)19)10-22-18-7-13(9-21)16-8-14(20)5-6-17(16)24-18/h2-8,11H,10H2,1H3,(H,22,24)
InChIKeyCFNAMULYHOJVHS-UHFFFAOYSA-N
XLogP4.33
TPSA66.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.81
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-chloro-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]pyrazin-2-amine
CID 133296691
6,8-dimethyl-4-[(5-methylimidazo[1,2-a]pyridin-2-yl)methylamino]quinoline-3-carbonitrile
CID 133321621
6-chloro-2-[(1,3-dihydroxy-2-methylpropan-2-yl)amino]quinoline-4-carbonitrile
CID 133429186
3-cyano-4-[(5-methylimidazo[1,2-a]pyridin-2-yl)methylamino]benzenesulfonamide
CID 133321609
6-chloro-2-[[3-[(dimethylamino)methyl]-4-fluorophenyl]methylamino]quinoline-4-carbonitrile
CID 133304489
6-chloro-2-[(1-cyclopropylbenzimidazol-2-yl)methylamino]quinoline-4-carbonitrile
CID 133466696
3-[(6-chloro-4-cyanoquinolin-2-yl)amino]-N-phenylpropanamide
CID 133304285
2-[(4-chlorophenyl)methyl]-5-methylimidazo[1,2-a]pyridine
CID 117132832
5-chloro-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-nitrobenzamide
CID 56804285
6-chloro-2-[1-(1,3,5-trimethylpyrazol-4-yl)propylamino]quinoline-4-carbonitrile
CID 133427882
6-chloro-2-[[(2S)-1-hydroxybutan-2-yl]amino]quinoline-4-carbonitrile
CID 133434714
6-chloro-2-[2-(2,5-dioxoimidazolidin-1-yl)ethylamino]quinoline-4-carbonitrile
CID 133310077

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-[(5-methylimidazo[1,2-a]pyridin-2-yl)methylamino]quinoline-4-carbonitrile?
The IUPAC name of 6-chloro-2-[(5-methylimidazo[1,2-a]pyridin-2-yl)methylamino]quinoline-4-carbonitrile (CID 133309480) is 6-chloro-2-[(5-methylimidazo[1,2-a]pyridin-2-yl)methylamino]quinoline-4-carbonitrile.
What is the SMILES notation for 6-chloro-2-[(5-methylimidazo[1,2-a]pyridin-2-yl)methylamino]quinoline-4-carbonitrile?
The canonical SMILES for 6-chloro-2-[(5-methylimidazo[1,2-a]pyridin-2-yl)methylamino]quinoline-4-carbonitrile is Cc1cccc2nc(CNc3cc(C#N)c4cc(Cl)ccc4n3)cn12.
What is the InChIKey of 6-chloro-2-[(5-methylimidazo[1,2-a]pyridin-2-yl)methylamino]quinoline-4-carbonitrile?
The InChIKey is CFNAMULYHOJVHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14ClN5/c1-12-3-2-4-19-23-15(11-25(12)19)10-22-18-7-13(9-21)16-8-14(20)5-6-17(16)24-18/h2-8,11H,10H2,1H3,(H,22,24).
What are the key properties of 6-chloro-2-[(5-methylimidazo[1,2-a]pyridin-2-yl)methylamino]quinoline-4-carbonitrile?
6-chloro-2-[(5-methylimidazo[1,2-a]pyridin-2-yl)methylamino]quinoline-4-carbonitrile has a molecular weight of 347.81 g/mol, XLogP of 4.33, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-[(5-methylimidazo[1,2-a]pyridin-2-yl)methylamino]quinoline-4-carbonitrile is sourced from PubChem (CID 133309480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).