8-methoxy-N-methyl-N-(2-pyridin-2-ylethyl)-2H-chromene-3-carboxamide

C19H20N2O3 — CID 60616153

IUPAC8-methoxy-N-methyl-N-(2-pyridin-2-ylethyl)-2H-chromene-3-carboxamide
SMILESCOc1cccc2c1OCC(C(=O)N(C)CCc1ccccn1)=C2
InChIInChI=1S/C19H20N2O3/c1-21(11-9-16-7-3-4-10-20-16)19(22)15-12-14-6-5-8-17(23-2)18(14)24-13-15/h3-8,10,12H,9,11,13H2,1-2H3
InChIKeyAXOLEHZNESAAMQ-UHFFFAOYSA-N
MW324.38 g/mol
LogP2.57
Rot. Bonds5

About 8-methoxy-N-methyl-N-(2-pyridin-2-ylethyl)-2H-chromene-3-carboxamide

8-methoxy-N-methyl-N-(2-pyridin-2-ylethyl)-2H-chromene-3-carboxamide (PubChem CID 60616153) has the molecular formula C19H20N2O3 and a molecular weight of 324.38 g/mol. Its IUPAC name is 8-methoxy-N-methyl-N-(2-pyridin-2-ylethyl)-2H-chromene-3-carboxamide.

Molecular Properties

Compound Name8-methoxy-N-methyl-N-(2-pyridin-2-ylethyl)-2H-chromene-3-carboxamide
PubChem CID60616153
Molecular FormulaC19H20N2O3
Molecular Weight324.38 g/mol
Exact Mass324.15
IUPAC Name8-methoxy-N-methyl-N-(2-pyridin-2-ylethyl)-2H-chromene-3-carboxamide
SMILESCOc1cccc2c1OCC(C(=O)N(C)CCc1ccccn1)=C2
InChIInChI=1S/C19H20N2O3/c1-21(11-9-16-7-3-4-10-20-16)19(22)15-12-14-6-5-8-17(23-2)18(14)24-13-15/h3-8,10,12H,9,11,13H2,1-2H3
InChIKeyAXOLEHZNESAAMQ-UHFFFAOYSA-N
XLogP2.57
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(8-methoxy-2H-chromene-3-carbonyl)-(2-methoxyethyl)amino]acetic acid
CID 119188807
1-[2-[(8-methoxy-2H-chromene-3-carbonyl)-methylamino]acetyl]piperidine-4-carboxylic acid
CID 119235627
benzyl 8-methoxy-2H-chromene-3-carboxylate
CID 1475910
3-(2-methoxyphenyl)-1-methyl-1-(2-pyridin-2-ylethyl)urea
CID 16612937
4-fluoro-N-methyl-N-(2-pyridin-2-ylethyl)benzamide;oxalic acid
CID 90483378
8-methoxy-N-[2-(methylamino)ethyl]-2H-chromene-3-carboxamide;hydrochloride
CID 119500438
2-(2-methoxyphenoxy)-N-methyl-N-(2-pyridin-2-ylethyl)acetamide;phosphoric acid
CID 134110040
4-ethoxy-N-methyl-N-(2-pyridin-2-ylethyl)benzamide
CID 56809954
N-(3-aminobutyl)-8-methoxy-2H-chromene-3-carboxamide;hydrochloride
CID 119495370
N-methyl-4-phenoxy-N-(2-pyridin-2-ylethyl)benzamide
CID 78796251
[(3aS,6aR)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl]-(8-methoxy-2H-chromen-3-yl)methanone
CID 120658310
(Z)-4-(2-methoxyphenyl)-N,3-dimethyl-N-(2-pyridin-2-ylethyl)but-2-enamide
CID 98289260

Frequently Asked Questions

What is the IUPAC name of 8-methoxy-N-methyl-N-(2-pyridin-2-ylethyl)-2H-chromene-3-carboxamide?
The IUPAC name of 8-methoxy-N-methyl-N-(2-pyridin-2-ylethyl)-2H-chromene-3-carboxamide (CID 60616153) is 8-methoxy-N-methyl-N-(2-pyridin-2-ylethyl)-2H-chromene-3-carboxamide.
What is the SMILES notation for 8-methoxy-N-methyl-N-(2-pyridin-2-ylethyl)-2H-chromene-3-carboxamide?
The canonical SMILES for 8-methoxy-N-methyl-N-(2-pyridin-2-ylethyl)-2H-chromene-3-carboxamide is COc1cccc2c1OCC(C(=O)N(C)CCc1ccccn1)=C2.
What is the InChIKey of 8-methoxy-N-methyl-N-(2-pyridin-2-ylethyl)-2H-chromene-3-carboxamide?
The InChIKey is AXOLEHZNESAAMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O3/c1-21(11-9-16-7-3-4-10-20-16)19(22)15-12-14-6-5-8-17(23-2)18(14)24-13-15/h3-8,10,12H,9,11,13H2,1-2H3.
What are the key properties of 8-methoxy-N-methyl-N-(2-pyridin-2-ylethyl)-2H-chromene-3-carboxamide?
8-methoxy-N-methyl-N-(2-pyridin-2-ylethyl)-2H-chromene-3-carboxamide has a molecular weight of 324.38 g/mol, XLogP of 2.57, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-N-methyl-N-(2-pyridin-2-ylethyl)-2H-chromene-3-carboxamide is sourced from PubChem (CID 60616153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).