(4R)-6-chloro-N-(1-methylimidazo[4,5-c]pyridin-7-yl)-3,4-dihydro-2H-chromene-4-carboxamide

C17H15ClN4O2 — CID 169408247

IUPAC(4R)-6-chloro-N-(1-methylimidazo[4,5-c]pyridin-7-yl)-3,4-dihydro-2H-chromene-4-carboxamide
SMILESCn1cnc2cncc(NC(=O)[C@@H]3CCOc4ccc(Cl)cc43)c21
InChIInChI=1S/C17H15ClN4O2/c1-22-9-20-13-7-19-8-14(16(13)22)21-17(23)11-4-5-24-15-3-2-10(18)6-12(11)15/h2-3,6-9,11H,4-5H2,1H3,(H,21,23)/t11-/m1/s1
InChIKeyBKYVVDKZFPPWFC-LLVKDONJSA-N
MW342.79 g/mol
LogP3.13
Rot. Bonds2

About (4R)-6-chloro-N-(1-methylimidazo[4,5-c]pyridin-7-yl)-3,4-dihydro-2H-chromene-4-carboxamide

(4R)-6-chloro-N-(1-methylimidazo[4,5-c]pyridin-7-yl)-3,4-dihydro-2H-chromene-4-carboxamide (PubChem CID 169408247) has the molecular formula C17H15ClN4O2 and a molecular weight of 342.79 g/mol. Its IUPAC name is (4R)-6-chloro-N-(1-methylimidazo[4,5-c]pyridin-7-yl)-3,4-dihydro-2H-chromene-4-carboxamide.

Molecular Properties

Compound Name(4R)-6-chloro-N-(1-methylimidazo[4,5-c]pyridin-7-yl)-3,4-dihydro-2H-chromene-4-carboxamide
PubChem CID169408247
Molecular FormulaC17H15ClN4O2
Molecular Weight342.79 g/mol
Exact Mass342.09
IUPAC Name(4R)-6-chloro-N-(1-methylimidazo[4,5-c]pyridin-7-yl)-3,4-dihydro-2H-chromene-4-carboxamide
SMILESCn1cnc2cncc(NC(=O)[C@@H]3CCOc4ccc(Cl)cc43)c21
InChIInChI=1S/C17H15ClN4O2/c1-22-9-20-13-7-19-8-14(16(13)22)21-17(23)11-4-5-24-15-3-2-10(18)6-12(11)15/h2-3,6-9,11H,4-5H2,1H3,(H,21,23)/t11-/m1/s1
InChIKeyBKYVVDKZFPPWFC-LLVKDONJSA-N
XLogP3.13
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.79
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (4R)-6-chloro-N-(1-methylimidazo[4,5-c]pyridin-7-yl)-3,4-dihydro-2H-chromene-4-carboxamide?
The IUPAC name of (4R)-6-chloro-N-(1-methylimidazo[4,5-c]pyridin-7-yl)-3,4-dihydro-2H-chromene-4-carboxamide (CID 169408247) is (4R)-6-chloro-N-(1-methylimidazo[4,5-c]pyridin-7-yl)-3,4-dihydro-2H-chromene-4-carboxamide.
What is the SMILES notation for (4R)-6-chloro-N-(1-methylimidazo[4,5-c]pyridin-7-yl)-3,4-dihydro-2H-chromene-4-carboxamide?
The canonical SMILES for (4R)-6-chloro-N-(1-methylimidazo[4,5-c]pyridin-7-yl)-3,4-dihydro-2H-chromene-4-carboxamide is Cn1cnc2cncc(NC(=O)[C@@H]3CCOc4ccc(Cl)cc43)c21.
What is the InChIKey of (4R)-6-chloro-N-(1-methylimidazo[4,5-c]pyridin-7-yl)-3,4-dihydro-2H-chromene-4-carboxamide?
The InChIKey is BKYVVDKZFPPWFC-LLVKDONJSA-N. The full InChI is InChI=1S/C17H15ClN4O2/c1-22-9-20-13-7-19-8-14(16(13)22)21-17(23)11-4-5-24-15-3-2-10(18)6-12(11)15/h2-3,6-9,11H,4-5H2,1H3,(H,21,23)/t11-/m1/s1.
What are the key properties of (4R)-6-chloro-N-(1-methylimidazo[4,5-c]pyridin-7-yl)-3,4-dihydro-2H-chromene-4-carboxamide?
(4R)-6-chloro-N-(1-methylimidazo[4,5-c]pyridin-7-yl)-3,4-dihydro-2H-chromene-4-carboxamide has a molecular weight of 342.79 g/mol, XLogP of 3.13, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-6-chloro-N-(1-methylimidazo[4,5-c]pyridin-7-yl)-3,4-dihydro-2H-chromene-4-carboxamide is sourced from PubChem (CID 169408247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).