2,6-dimethyl-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]quinoline-3-carboxamide

C20H22N4O — CID 95135738

IUPAC2,6-dimethyl-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]quinoline-3-carboxamide
SMILESCc1ccc2nc(C)c(C(=O)N[C@@H]3CCc4nc(C)cn4C3)cc2c1
InChIInChI=1S/C20H22N4O/c1-12-4-6-18-15(8-12)9-17(14(3)22-18)20(25)23-16-5-7-19-21-13(2)10-24(19)11-16/h4,6,8-10,16H,5,7,11H2,1-3H3,(H,23,25)/t16-/m1/s1
InChIKeyKXTQWAAYOOXEPI-MRXNPFEDSA-N
MW334.42 g/mol
LogP3.10
Rot. Bonds2

About 2,6-dimethyl-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]quinoline-3-carboxamide

2,6-dimethyl-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]quinoline-3-carboxamide (PubChem CID 95135738) has the molecular formula C20H22N4O and a molecular weight of 334.42 g/mol. Its IUPAC name is 2,6-dimethyl-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]quinoline-3-carboxamide.

Molecular Properties

Compound Name2,6-dimethyl-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]quinoline-3-carboxamide
PubChem CID95135738
Molecular FormulaC20H22N4O
Molecular Weight334.42 g/mol
Exact Mass334.18
IUPAC Name2,6-dimethyl-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]quinoline-3-carboxamide
SMILESCc1ccc2nc(C)c(C(=O)N[C@@H]3CCc4nc(C)cn4C3)cc2c1
InChIInChI=1S/C20H22N4O/c1-12-4-6-18-15(8-12)9-17(14(3)22-18)20(25)23-16-5-7-19-21-13(2)10-24(19)11-16/h4,6,8-10,16H,5,7,11H2,1-3H3,(H,23,25)/t16-/m1/s1
InChIKeyKXTQWAAYOOXEPI-MRXNPFEDSA-N
XLogP3.10
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]quinoline-3-carboxamide?
The IUPAC name of 2,6-dimethyl-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]quinoline-3-carboxamide (CID 95135738) is 2,6-dimethyl-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]quinoline-3-carboxamide.
What is the SMILES notation for 2,6-dimethyl-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]quinoline-3-carboxamide?
The canonical SMILES for 2,6-dimethyl-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]quinoline-3-carboxamide is Cc1ccc2nc(C)c(C(=O)N[C@@H]3CCc4nc(C)cn4C3)cc2c1.
What is the InChIKey of 2,6-dimethyl-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]quinoline-3-carboxamide?
The InChIKey is KXTQWAAYOOXEPI-MRXNPFEDSA-N. The full InChI is InChI=1S/C20H22N4O/c1-12-4-6-18-15(8-12)9-17(14(3)22-18)20(25)23-16-5-7-19-21-13(2)10-24(19)11-16/h4,6,8-10,16H,5,7,11H2,1-3H3,(H,23,25)/t16-/m1/s1.
What are the key properties of 2,6-dimethyl-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]quinoline-3-carboxamide?
2,6-dimethyl-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]quinoline-3-carboxamide has a molecular weight of 334.42 g/mol, XLogP of 3.10, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]quinoline-3-carboxamide is sourced from PubChem (CID 95135738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).