N-(3,4-dihydro-2H-chromen-3-ylmethyl)-3-methylfuran-2-carboxamide

C16H17NO3 — CID 51241210

IUPACN-(3,4-dihydro-2H-chromen-3-ylmethyl)-3-methylfuran-2-carboxamide
SMILESCc1ccoc1C(=O)NCC1COc2ccccc2C1
InChIInChI=1S/C16H17NO3/c1-11-6-7-19-15(11)16(18)17-9-12-8-13-4-2-3-5-14(13)20-10-12/h2-7,12H,8-10H2,1H3,(H,17,18)
InChIKeyZROYDOPIJVRTAW-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.57
Rot. Bonds3

About N-(3,4-dihydro-2H-chromen-3-ylmethyl)-3-methylfuran-2-carboxamide

N-(3,4-dihydro-2H-chromen-3-ylmethyl)-3-methylfuran-2-carboxamide (PubChem CID 51241210) has the molecular formula C16H17NO3 and a molecular weight of 271.32 g/mol. Its IUPAC name is N-(3,4-dihydro-2H-chromen-3-ylmethyl)-3-methylfuran-2-carboxamide.

Molecular Properties

Compound NameN-(3,4-dihydro-2H-chromen-3-ylmethyl)-3-methylfuran-2-carboxamide
PubChem CID51241210
Molecular FormulaC16H17NO3
Molecular Weight271.32 g/mol
Exact Mass271.12
IUPAC NameN-(3,4-dihydro-2H-chromen-3-ylmethyl)-3-methylfuran-2-carboxamide
SMILESCc1ccoc1C(=O)NCC1COc2ccccc2C1
InChIInChI=1S/C16H17NO3/c1-11-6-7-19-15(11)16(18)17-9-12-8-13-4-2-3-5-14(13)20-10-12/h2-7,12H,8-10H2,1H3,(H,17,18)
InChIKeyZROYDOPIJVRTAW-UHFFFAOYSA-N
XLogP2.57
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3,4-dihydro-2H-chromen-3-ylmethyl)-2-methylbenzamide
CID 51211932
1-(3,4-dihydro-2H-chromen-3-ylmethyl)-3-ethylurea
CID 47117479
N-[[(3S)-3,4-dihydro-2H-chromen-3-yl]methyl]-1,4,6-trimethyl-2-oxopyridine-3-carboxamide
CID 97129298
N-[[(3R)-3,4-dihydro-2H-chromen-3-yl]methyl]pyridine-2-carboxamide
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N-[[(3R)-3,4-dihydro-2H-chromen-3-yl]methyl]-4-(trifluoromethyl)benzamide
CID 40918040
N-[[(3R)-3,4-dihydro-2H-chromen-3-yl]methyl]-1-methylpyrazole-4-carboxamide
CID 35422359
N-(3,4-dihydro-2H-chromen-3-ylmethyl)-3-methyl-5-(methylamino)-1,2-thiazole-4-carboxamide
CID 102556261
N-(3,4-dihydro-2H-chromen-3-ylmethyl)pyrazine-2-carboxamide
CID 47115544
N-(3,4-dihydro-2H-chromen-3-ylmethyl)-5-propyl-1,2-oxazole-3-carboxamide
CID 72915757
N-(3,4-dihydro-2H-chromen-3-ylmethyl)-2-(2-ethoxyethoxy)benzamide
CID 72880928
(2E,4E)-N-(3,4-dihydro-2H-chromen-3-ylmethyl)hexa-2,4-dienamide
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N-(3,4-dihydro-2H-chromen-3-ylmethyl)-3-ethylsulfanylpropanamide
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Frequently Asked Questions

What is the IUPAC name of N-(3,4-dihydro-2H-chromen-3-ylmethyl)-3-methylfuran-2-carboxamide?
The IUPAC name of N-(3,4-dihydro-2H-chromen-3-ylmethyl)-3-methylfuran-2-carboxamide (CID 51241210) is N-(3,4-dihydro-2H-chromen-3-ylmethyl)-3-methylfuran-2-carboxamide.
What is the SMILES notation for N-(3,4-dihydro-2H-chromen-3-ylmethyl)-3-methylfuran-2-carboxamide?
The canonical SMILES for N-(3,4-dihydro-2H-chromen-3-ylmethyl)-3-methylfuran-2-carboxamide is Cc1ccoc1C(=O)NCC1COc2ccccc2C1.
What is the InChIKey of N-(3,4-dihydro-2H-chromen-3-ylmethyl)-3-methylfuran-2-carboxamide?
The InChIKey is ZROYDOPIJVRTAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO3/c1-11-6-7-19-15(11)16(18)17-9-12-8-13-4-2-3-5-14(13)20-10-12/h2-7,12H,8-10H2,1H3,(H,17,18).
What are the key properties of N-(3,4-dihydro-2H-chromen-3-ylmethyl)-3-methylfuran-2-carboxamide?
N-(3,4-dihydro-2H-chromen-3-ylmethyl)-3-methylfuran-2-carboxamide has a molecular weight of 271.32 g/mol, XLogP of 2.57, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dihydro-2H-chromen-3-ylmethyl)-3-methylfuran-2-carboxamide is sourced from PubChem (CID 51241210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).