6-chloro-N-imidazo[1,2-a]pyridin-3-yl-3,4-dihydro-2H-chromene-4-carboxamide

C17H14ClN3O2 — CID 156906169

IUPAC6-chloro-N-imidazo[1,2-a]pyridin-3-yl-3,4-dihydro-2H-chromene-4-carboxamide
SMILESO=C(Nc1cnc2ccccn12)C1CCOc2ccc(Cl)cc21
InChIInChI=1S/C17H14ClN3O2/c18-11-4-5-14-13(9-11)12(6-8-23-14)17(22)20-16-10-19-15-3-1-2-7-21(15)16/h1-5,7,9-10,12H,6,8H2,(H,20,22)
InChIKeyIXUNYIMCNPGMQN-UHFFFAOYSA-N
MW327.77 g/mol
LogP3.49
Rot. Bonds2

About 6-chloro-N-imidazo[1,2-a]pyridin-3-yl-3,4-dihydro-2H-chromene-4-carboxamide

6-chloro-N-imidazo[1,2-a]pyridin-3-yl-3,4-dihydro-2H-chromene-4-carboxamide (PubChem CID 156906169) has the molecular formula C17H14ClN3O2 and a molecular weight of 327.77 g/mol. Its IUPAC name is 6-chloro-N-imidazo[1,2-a]pyridin-3-yl-3,4-dihydro-2H-chromene-4-carboxamide.

Molecular Properties

Compound Name6-chloro-N-imidazo[1,2-a]pyridin-3-yl-3,4-dihydro-2H-chromene-4-carboxamide
PubChem CID156906169
Molecular FormulaC17H14ClN3O2
Molecular Weight327.77 g/mol
Exact Mass327.08
IUPAC Name6-chloro-N-imidazo[1,2-a]pyridin-3-yl-3,4-dihydro-2H-chromene-4-carboxamide
SMILESO=C(Nc1cnc2ccccn12)C1CCOc2ccc(Cl)cc21
InChIInChI=1S/C17H14ClN3O2/c18-11-4-5-14-13(9-11)12(6-8-23-14)17(22)20-16-10-19-15-3-1-2-7-21(15)16/h1-5,7,9-10,12H,6,8H2,(H,20,22)
InChIKeyIXUNYIMCNPGMQN-UHFFFAOYSA-N
XLogP3.49
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.77
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-imidazo[1,2-a]pyridin-3-yl-3,4-dihydro-2H-chromene-4-carboxamide?
The IUPAC name of 6-chloro-N-imidazo[1,2-a]pyridin-3-yl-3,4-dihydro-2H-chromene-4-carboxamide (CID 156906169) is 6-chloro-N-imidazo[1,2-a]pyridin-3-yl-3,4-dihydro-2H-chromene-4-carboxamide.
What is the SMILES notation for 6-chloro-N-imidazo[1,2-a]pyridin-3-yl-3,4-dihydro-2H-chromene-4-carboxamide?
The canonical SMILES for 6-chloro-N-imidazo[1,2-a]pyridin-3-yl-3,4-dihydro-2H-chromene-4-carboxamide is O=C(Nc1cnc2ccccn12)C1CCOc2ccc(Cl)cc21.
What is the InChIKey of 6-chloro-N-imidazo[1,2-a]pyridin-3-yl-3,4-dihydro-2H-chromene-4-carboxamide?
The InChIKey is IXUNYIMCNPGMQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14ClN3O2/c18-11-4-5-14-13(9-11)12(6-8-23-14)17(22)20-16-10-19-15-3-1-2-7-21(15)16/h1-5,7,9-10,12H,6,8H2,(H,20,22).
What are the key properties of 6-chloro-N-imidazo[1,2-a]pyridin-3-yl-3,4-dihydro-2H-chromene-4-carboxamide?
6-chloro-N-imidazo[1,2-a]pyridin-3-yl-3,4-dihydro-2H-chromene-4-carboxamide has a molecular weight of 327.77 g/mol, XLogP of 3.49, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-imidazo[1,2-a]pyridin-3-yl-3,4-dihydro-2H-chromene-4-carboxamide is sourced from PubChem (CID 156906169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).