6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide

C11H13NO3 — CID 47170033

IUPAC6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide
SMILESCOc1ccc2c(c1)CC(C(N)=O)CO2
InChIInChI=1S/C11H13NO3/c1-14-9-2-3-10-7(5-9)4-8(6-15-10)11(12)13/h2-3,5,8H,4,6H2,1H3,(H2,12,13)
InChIKeyRLYZRJJCUZGZRS-UHFFFAOYSA-N
MW207.23 g/mol
LogP0.73
Rot. Bonds2

About 6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide

6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide (PubChem CID 47170033) has the molecular formula C11H13NO3 and a molecular weight of 207.23 g/mol. Its IUPAC name is 6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide.

Molecular Properties

Compound Name6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide
PubChem CID47170033
Molecular FormulaC11H13NO3
Molecular Weight207.23 g/mol
Exact Mass207.09
IUPAC Name6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide
SMILESCOc1ccc2c(c1)CC(C(N)=O)CO2
InChIInChI=1S/C11H13NO3/c1-14-9-2-3-10-7(5-9)4-8(6-15-10)11(12)13/h2-3,5,8H,4,6H2,1H3,(H2,12,13)
InChIKeyRLYZRJJCUZGZRS-UHFFFAOYSA-N
XLogP0.73
TPSA61.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.23
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-6-methoxy-3,4-dihydro-2H-chromene-3-carboxylic acid
CID 7061285
6-amino-3,4-dihydro-2H-chromene-3-carboxamide
CID 43209471
6-methoxy-N-propyl-3,4-dihydro-2H-chromene-3-carboxamide
CID 22578230
2-[(6-methoxy-3,4-dihydro-2H-chromene-3-carbonyl)-methylamino]propanoic acid
CID 119358196
N-(1-amino-2-methylpropan-2-yl)-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide
CID 119523565
(4-aminopiperidin-1-yl)-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)methanone;hydrochloride
CID 119375217
(3S)-6-methoxy-N-methyl-N-(1,3,4-thiadiazol-2-yl)-3,4-dihydro-2H-chromene-3-carboxamide
CID 124617356
3-[(6-methoxy-3,4-dihydro-2H-chromene-3-carbonyl)amino]propanoic acid
CID 119350891
N-[(3,4-dimethoxyphenyl)methyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide
CID 22578299
2-[(6-methoxy-3,4-dihydro-2H-chromene-3-carbonyl)amino]-3-methylbutanoic acid
CID 119348268
N-(1-amino-2-cyclopropylpropan-2-yl)-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide;hydrochloride
CID 119574427
(3S)-N-[(2,4-dimethoxyphenyl)methyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide
CID 92713329

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide?
The IUPAC name of 6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide (CID 47170033) is 6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide.
What is the SMILES notation for 6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide?
The canonical SMILES for 6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide is COc1ccc2c(c1)CC(C(N)=O)CO2.
What is the InChIKey of 6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide?
The InChIKey is RLYZRJJCUZGZRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO3/c1-14-9-2-3-10-7(5-9)4-8(6-15-10)11(12)13/h2-3,5,8H,4,6H2,1H3,(H2,12,13).
What are the key properties of 6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide?
6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide has a molecular weight of 207.23 g/mol, XLogP of 0.73, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide is sourced from PubChem (CID 47170033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).