N-[(2R)-1-(furan-2-yl)propan-2-yl]-6-methoxy-2H-chromene-3-carboxamide

C18H19NO4 — CID 92713356

IUPACN-[(2R)-1-(furan-2-yl)propan-2-yl]-6-methoxy-2H-chromene-3-carboxamide
SMILESCOc1ccc2c(c1)C=C(C(=O)N[C@H](C)Cc1ccco1)CO2
InChIInChI=1S/C18H19NO4/c1-12(8-16-4-3-7-22-16)19-18(20)14-9-13-10-15(21-2)5-6-17(13)23-11-14/h3-7,9-10,12H,8,11H2,1-2H3,(H,19,20)/t12-/m1/s1
InChIKeyWVCJHCAHFYAEIJ-GFCCVEGCSA-N
MW313.35 g/mol
LogP2.81
Rot. Bonds5

About N-[(2R)-1-(furan-2-yl)propan-2-yl]-6-methoxy-2H-chromene-3-carboxamide

N-[(2R)-1-(furan-2-yl)propan-2-yl]-6-methoxy-2H-chromene-3-carboxamide (PubChem CID 92713356) has the molecular formula C18H19NO4 and a molecular weight of 313.35 g/mol. Its IUPAC name is N-[(2R)-1-(furan-2-yl)propan-2-yl]-6-methoxy-2H-chromene-3-carboxamide.

Molecular Properties

Compound NameN-[(2R)-1-(furan-2-yl)propan-2-yl]-6-methoxy-2H-chromene-3-carboxamide
PubChem CID92713356
Molecular FormulaC18H19NO4
Molecular Weight313.35 g/mol
Exact Mass313.13
IUPAC NameN-[(2R)-1-(furan-2-yl)propan-2-yl]-6-methoxy-2H-chromene-3-carboxamide
SMILESCOc1ccc2c(c1)C=C(C(=O)N[C@H](C)Cc1ccco1)CO2
InChIInChI=1S/C18H19NO4/c1-12(8-16-4-3-7-22-16)19-18(20)14-9-13-10-15(21-2)5-6-17(13)23-11-14/h3-7,9-10,12H,8,11H2,1-2H3,(H,19,20)/t12-/m1/s1
InChIKeyWVCJHCAHFYAEIJ-GFCCVEGCSA-N
XLogP2.81
TPSA60.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.35
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(furan-2-yl)propan-2-yl]-6-methoxy-2H-chromene-3-carboxamide
CID 22578380
N-[(2R)-2-(ethylamino)propyl]-6-methoxy-2H-chromene-3-carboxamide
CID 120654267
N-(2,6-dimethylphenyl)-6-methoxy-2H-chromene-3-carboxamide
CID 22578350
1-[1-(furan-2-yl)propan-2-yl]-3-(3-methoxyphenyl)urea
CID 47172007
6-ethoxy-N-(furan-2-ylmethyl)-N-methyl-2H-chromene-3-carboxamide
CID 53498513
6-methoxy-N-(piperidin-3-ylmethyl)-2H-chromene-3-carboxamide;hydrochloride
CID 119461393
3-[(6-chloro-2H-chromene-3-carbonyl)amino]butanoic acid
CID 43242074
N-(3,5-dimethoxyphenyl)-6-ethoxy-2H-chromene-3-carboxamide
CID 46488602
5-chloro-2-fluoro-N-[1-(furan-2-yl)propan-2-yl]benzamide
CID 47168787
3-(2H-chromene-3-carbonylamino)butanoic acid
CID 119220849
N-[1-(furan-2-yl)propan-2-yl]benzamide
CID 47148390
N-[1-(furan-2-yl)propan-2-yl]-4-iodobenzamide
CID 47168762

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-(furan-2-yl)propan-2-yl]-6-methoxy-2H-chromene-3-carboxamide?
The IUPAC name of N-[(2R)-1-(furan-2-yl)propan-2-yl]-6-methoxy-2H-chromene-3-carboxamide (CID 92713356) is N-[(2R)-1-(furan-2-yl)propan-2-yl]-6-methoxy-2H-chromene-3-carboxamide.
What is the SMILES notation for N-[(2R)-1-(furan-2-yl)propan-2-yl]-6-methoxy-2H-chromene-3-carboxamide?
The canonical SMILES for N-[(2R)-1-(furan-2-yl)propan-2-yl]-6-methoxy-2H-chromene-3-carboxamide is COc1ccc2c(c1)C=C(C(=O)N[C@H](C)Cc1ccco1)CO2.
What is the InChIKey of N-[(2R)-1-(furan-2-yl)propan-2-yl]-6-methoxy-2H-chromene-3-carboxamide?
The InChIKey is WVCJHCAHFYAEIJ-GFCCVEGCSA-N. The full InChI is InChI=1S/C18H19NO4/c1-12(8-16-4-3-7-22-16)19-18(20)14-9-13-10-15(21-2)5-6-17(13)23-11-14/h3-7,9-10,12H,8,11H2,1-2H3,(H,19,20)/t12-/m1/s1.
What are the key properties of N-[(2R)-1-(furan-2-yl)propan-2-yl]-6-methoxy-2H-chromene-3-carboxamide?
N-[(2R)-1-(furan-2-yl)propan-2-yl]-6-methoxy-2H-chromene-3-carboxamide has a molecular weight of 313.35 g/mol, XLogP of 2.81, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-(furan-2-yl)propan-2-yl]-6-methoxy-2H-chromene-3-carboxamide is sourced from PubChem (CID 92713356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).