N,N-diethyl-3,4-dihydro-2H-chromene-6-carboxamide

C14H19NO2 — CID 110693371

IUPACN,N-diethyl-3,4-dihydro-2H-chromene-6-carboxamide
SMILESCCN(CC)C(=O)c1ccc2c(c1)CCCO2
InChIInChI=1S/C14H19NO2/c1-3-15(4-2)14(16)12-7-8-13-11(10-12)6-5-9-17-13/h7-8,10H,3-6,9H2,1-2H3
InChIKeyZTCFVBZMFQJAJU-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.49
Rot. Bonds3

About N,N-diethyl-3,4-dihydro-2H-chromene-6-carboxamide

N,N-diethyl-3,4-dihydro-2H-chromene-6-carboxamide (PubChem CID 110693371) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is N,N-diethyl-3,4-dihydro-2H-chromene-6-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-3,4-dihydro-2H-chromene-6-carboxamide
PubChem CID110693371
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC NameN,N-diethyl-3,4-dihydro-2H-chromene-6-carboxamide
SMILESCCN(CC)C(=O)c1ccc2c(c1)CCCO2
InChIInChI=1S/C14H19NO2/c1-3-15(4-2)14(16)12-7-8-13-11(10-12)6-5-9-17-13/h7-8,10H,3-6,9H2,1-2H3
InChIKeyZTCFVBZMFQJAJU-UHFFFAOYSA-N
XLogP2.49
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-chloroethyl)-N-ethyl-2,3-dihydro-1-benzofuran-5-carboxamide
CID 63395170
N-butyl-N-methyl-3,4-dihydro-2H-chromene-6-carboxamide
CID 110693378
1-(3,4-dihydro-2H-chromen-6-yl)pentan-1-one
CID 61027347
2-amino-1-(3,4-dihydro-2H-chromen-6-yl)ethanone
CID 10352535
N-(3-amino-3-hydroxyiminopropyl)-N-ethyl-2,3-dihydro-1-benzofuran-5-carboxamide
CID 76936987
N-ethyl-N-(piperidin-4-ylmethyl)-2,3-dihydro-1-benzofuran-5-carboxamide
CID 79698342
1-(3,4-dihydro-2H-chromen-6-yl)-2-hydroxy-2-methylpropan-1-one
CID 116920405
N-ethyl-N-(2-hydroxyethyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
CID 60682298
2-[2,3-dihydro-1-benzofuran-5-carbonyl(propyl)amino]acetic acid
CID 61013012
4-(2,3-dihydro-1-benzofuran-5-ylsulfonylamino)-N,N-diethylbenzamide
CID 51177921
1-(3,4-dihydro-2H-chromen-6-yl)-3-(methylamino)propan-1-one
CID 82493834
[3-(3,4-dihydro-2H-chromen-6-yl)-3-oxopropyl]-dimethylazanium
CID 7214406

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-3,4-dihydro-2H-chromene-6-carboxamide?
The IUPAC name of N,N-diethyl-3,4-dihydro-2H-chromene-6-carboxamide (CID 110693371) is N,N-diethyl-3,4-dihydro-2H-chromene-6-carboxamide.
What is the SMILES notation for N,N-diethyl-3,4-dihydro-2H-chromene-6-carboxamide?
The canonical SMILES for N,N-diethyl-3,4-dihydro-2H-chromene-6-carboxamide is CCN(CC)C(=O)c1ccc2c(c1)CCCO2.
What is the InChIKey of N,N-diethyl-3,4-dihydro-2H-chromene-6-carboxamide?
The InChIKey is ZTCFVBZMFQJAJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c1-3-15(4-2)14(16)12-7-8-13-11(10-12)6-5-9-17-13/h7-8,10H,3-6,9H2,1-2H3.
What are the key properties of N,N-diethyl-3,4-dihydro-2H-chromene-6-carboxamide?
N,N-diethyl-3,4-dihydro-2H-chromene-6-carboxamide has a molecular weight of 233.31 g/mol, XLogP of 2.49, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-3,4-dihydro-2H-chromene-6-carboxamide is sourced from PubChem (CID 110693371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).