N-[(4-chlorophenyl)methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide

C20H15ClN2O2 — CID 121363663

IUPACN-[(4-chlorophenyl)methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide
SMILESO=C(NCc1ccc(Cl)cc1)c1ccc2c(c1)OCc1cnccc1-2
InChIInChI=1S/C20H15ClN2O2/c21-16-4-1-13(2-5-16)10-23-20(24)14-3-6-18-17-7-8-22-11-15(17)12-25-19(18)9-14/h1-9,11H,10,12H2,(H,23,24)
InChIKeyLEMZEKJDJABDQJ-UHFFFAOYSA-N
MW350.81 g/mol
LogP4.22
Rot. Bonds3

About N-[(4-chlorophenyl)methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide

N-[(4-chlorophenyl)methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide (PubChem CID 121363663) has the molecular formula C20H15ClN2O2 and a molecular weight of 350.81 g/mol. Its IUPAC name is N-[(4-chlorophenyl)methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide.

Molecular Properties

Compound NameN-[(4-chlorophenyl)methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide
PubChem CID121363663
Molecular FormulaC20H15ClN2O2
Molecular Weight350.81 g/mol
Exact Mass350.08
IUPAC NameN-[(4-chlorophenyl)methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide
SMILESO=C(NCc1ccc(Cl)cc1)c1ccc2c(c1)OCc1cnccc1-2
InChIInChI=1S/C20H15ClN2O2/c21-16-4-1-13(2-5-16)10-23-20(24)14-3-6-18-17-7-8-22-11-15(17)12-25-19(18)9-14/h1-9,11H,10,12H2,(H,23,24)
InChIKeyLEMZEKJDJABDQJ-UHFFFAOYSA-N
XLogP4.22
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.81
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-cyanophenyl)methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide
CID 121363595
N-[[3-(ethylcarbamoyl)phenyl]methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide
CID 121363594
N-[(2-chloro-5-fluorophenyl)methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide
CID 121363730
N-(1H-1,2,4-triazol-5-ylmethyl)-5H-chromeno[3,4-c]pyridine-8-carboxamide
CID 121363835
N-[[3-[ethyl(methyl)carbamoyl]phenyl]methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide
CID 129159098
N-[[3-(azetidine-1-carbonyl)phenyl]methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide
CID 121363503
N-[(2,6-difluoro-3-methoxyphenyl)methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide
CID 121363723
N-[[3-[(3S)-3-hydroxypyrrolidine-1-carbonyl]phenyl]methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide
CID 121363833
N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide
CID 121363848
N-[[3-(2-methylsulfonylpyrimidin-5-yl)phenyl]methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide
CID 121363553
N-[(4-bromo-1-ethylpyrazol-3-yl)methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide
CID 121363583
N-[[3-(3-methoxyazetidine-1-carbonyl)phenyl]methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide
CID 129159089

Frequently Asked Questions

What is the IUPAC name of N-[(4-chlorophenyl)methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide?
The IUPAC name of N-[(4-chlorophenyl)methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide (CID 121363663) is N-[(4-chlorophenyl)methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide.
What is the SMILES notation for N-[(4-chlorophenyl)methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide?
The canonical SMILES for N-[(4-chlorophenyl)methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide is O=C(NCc1ccc(Cl)cc1)c1ccc2c(c1)OCc1cnccc1-2.
What is the InChIKey of N-[(4-chlorophenyl)methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide?
The InChIKey is LEMZEKJDJABDQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15ClN2O2/c21-16-4-1-13(2-5-16)10-23-20(24)14-3-6-18-17-7-8-22-11-15(17)12-25-19(18)9-14/h1-9,11H,10,12H2,(H,23,24).
What are the key properties of N-[(4-chlorophenyl)methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide?
N-[(4-chlorophenyl)methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide has a molecular weight of 350.81 g/mol, XLogP of 4.22, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-chlorophenyl)methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide is sourced from PubChem (CID 121363663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).