N-(2,3-dihydro-1-benzofuran-5-ylmethyl)pentanamide

C14H19NO2 — CID 110787032

IUPACN-(2,3-dihydro-1-benzofuran-5-ylmethyl)pentanamide
SMILESCCCCC(=O)NCc1ccc2c(c1)CCO2
InChIInChI=1S/C14H19NO2/c1-2-3-4-14(16)15-10-11-5-6-13-12(9-11)7-8-17-13/h5-6,9H,2-4,7-8,10H2,1H3,(H,15,16)
InChIKeyRXWWQWUYPBCANH-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.43
Rot. Bonds5

About N-(2,3-dihydro-1-benzofuran-5-ylmethyl)pentanamide

N-(2,3-dihydro-1-benzofuran-5-ylmethyl)pentanamide (PubChem CID 110787032) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is N-(2,3-dihydro-1-benzofuran-5-ylmethyl)pentanamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1-benzofuran-5-ylmethyl)pentanamide
PubChem CID110787032
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC NameN-(2,3-dihydro-1-benzofuran-5-ylmethyl)pentanamide
SMILESCCCCC(=O)NCc1ccc2c(c1)CCO2
InChIInChI=1S/C14H19NO2/c1-2-3-4-14(16)15-10-11-5-6-13-12(9-11)7-8-17-13/h5-6,9H,2-4,7-8,10H2,1H3,(H,15,16)
InChIKeyRXWWQWUYPBCANH-UHFFFAOYSA-N
XLogP2.43
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-sulfanylacetamide
CID 115167217
N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-6-[(2-sulfanylacetyl)amino]hexanamide
CID 58608886
N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-oxopropanamide
CID 115175685
3-amino-N-(3,4-dihydro-2H-chromen-6-ylmethyl)propanamide
CID 82496307
2-(2,3-dihydro-1-benzofuran-5-ylmethylamino)-2-oxoacetic acid
CID 115141351
N-[2-(3,4-dihydro-2H-chromen-6-yl)ethyl]butanamide
CID 110790414
(E)-4-(2,3-dihydro-1-benzofuran-5-ylmethylamino)-4-oxobut-2-enoic acid
CID 115177230
N-(2,3-dihydro-1-benzofuran-5-ylmethyl)hexan-1-amine
CID 43804174
N-(3,4-dihydro-2H-chromen-6-ylmethyl)-3-(3,4-dimethoxyphenyl)propanamide
CID 91831785
sodium 4-[[4-(2,3-dihydro-1-benzofuran-5-yl)phenyl]methylamino]-4-oxobutanoate
CID 167799892
N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-(3-methoxyphenyl)acetamide
CID 110787098
4-(2,3-dihydro-1-benzofuran-5-ylmethylamino)butan-2-one
CID 115235717

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1-benzofuran-5-ylmethyl)pentanamide?
The IUPAC name of N-(2,3-dihydro-1-benzofuran-5-ylmethyl)pentanamide (CID 110787032) is N-(2,3-dihydro-1-benzofuran-5-ylmethyl)pentanamide.
What is the SMILES notation for N-(2,3-dihydro-1-benzofuran-5-ylmethyl)pentanamide?
The canonical SMILES for N-(2,3-dihydro-1-benzofuran-5-ylmethyl)pentanamide is CCCCC(=O)NCc1ccc2c(c1)CCO2.
What is the InChIKey of N-(2,3-dihydro-1-benzofuran-5-ylmethyl)pentanamide?
The InChIKey is RXWWQWUYPBCANH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c1-2-3-4-14(16)15-10-11-5-6-13-12(9-11)7-8-17-13/h5-6,9H,2-4,7-8,10H2,1H3,(H,15,16).
What are the key properties of N-(2,3-dihydro-1-benzofuran-5-ylmethyl)pentanamide?
N-(2,3-dihydro-1-benzofuran-5-ylmethyl)pentanamide has a molecular weight of 233.31 g/mol, XLogP of 2.43, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1-benzofuran-5-ylmethyl)pentanamide is sourced from PubChem (CID 110787032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).