N-cyclobutyl-N-(3-hydroxypropyl)-1-benzofuran-2-carboxamide

C16H19NO3 — CID 102866226

IUPACN-cyclobutyl-N-(3-hydroxypropyl)-1-benzofuran-2-carboxamide
SMILESO=C(c1cc2ccccc2o1)N(CCCO)C1CCC1
InChIInChI=1S/C16H19NO3/c18-10-4-9-17(13-6-3-7-13)16(19)15-11-12-5-1-2-8-14(12)20-15/h1-2,5,8,11,13,18H,3-4,6-7,9-10H2
InChIKeyPBNAGCDPJACXIZ-UHFFFAOYSA-N
MW273.33 g/mol
LogP2.81
Rot. Bonds5

About N-cyclobutyl-N-(3-hydroxypropyl)-1-benzofuran-2-carboxamide

N-cyclobutyl-N-(3-hydroxypropyl)-1-benzofuran-2-carboxamide (PubChem CID 102866226) has the molecular formula C16H19NO3 and a molecular weight of 273.33 g/mol. Its IUPAC name is N-cyclobutyl-N-(3-hydroxypropyl)-1-benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-cyclobutyl-N-(3-hydroxypropyl)-1-benzofuran-2-carboxamide
PubChem CID102866226
Molecular FormulaC16H19NO3
Molecular Weight273.33 g/mol
Exact Mass273.14
IUPAC NameN-cyclobutyl-N-(3-hydroxypropyl)-1-benzofuran-2-carboxamide
SMILESO=C(c1cc2ccccc2o1)N(CCCO)C1CCC1
InChIInChI=1S/C16H19NO3/c18-10-4-9-17(13-6-3-7-13)16(19)15-11-12-5-1-2-8-14(12)20-15/h1-2,5,8,11,13,18H,3-4,6-7,9-10H2
InChIKeyPBNAGCDPJACXIZ-UHFFFAOYSA-N
XLogP2.81
TPSA53.68 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.33
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-cyclobutyl-N-(3-hydroxypropyl)-1-benzofuran-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-aminoethyl)-N-cyclopentyl-1-benzofuran-2-carboxamide
CID 63754807
N-cyclohexyl-N-ethyl-1-benzofuran-2-carboxamide
CID 60592186
N-cyclobutyl-N-(2-hydroxyethyl)-5-methyl-1-benzofuran-2-carboxamide
CID 102684442
N-(3-hydroxypropyl)-N-propan-2-yl-1-benzofuran-2-carboxamide
CID 54916950
N-(3-bromopropyl)-N-cyclobutyl-5-methyl-1-benzofuran-2-carboxamide
CID 102872366
5-bromo-N-cyclobutyl-N-(3-hydroxypropyl)furan-2-carboxamide
CID 102862780
N-cyclobutyl-N-(3-hydroxypropyl)-3-methyl-1-benzofuran-2-carboxamide
CID 102866951
N-(oxan-4-yl)-N-(2,2,2-trifluoroethyl)-1-benzofuran-2-carboxamide
CID 71796118
N-(2-aminoethyl)-N-cyclopentyl-5-methyl-1-benzofuran-2-carboxamide
CID 63753713
2-amino-5-bromo-N-cyclobutyl-N-(3-hydroxypropyl)benzamide
CID 102864994
N-cyclopropyl-N-[[4-(cyclopropylcarbamoyl)phenyl]methyl]-1-benzofuran-2-carboxamide
CID 33340647
N-(2-hydroxycyclohexyl)-N-methyl-1-benzofuran-2-carboxamide
CID 102635560

Frequently Asked Questions

What is the IUPAC name of N-cyclobutyl-N-(3-hydroxypropyl)-1-benzofuran-2-carboxamide?
The IUPAC name of N-cyclobutyl-N-(3-hydroxypropyl)-1-benzofuran-2-carboxamide (CID 102866226) is N-cyclobutyl-N-(3-hydroxypropyl)-1-benzofuran-2-carboxamide.
What is the SMILES notation for N-cyclobutyl-N-(3-hydroxypropyl)-1-benzofuran-2-carboxamide?
The canonical SMILES for N-cyclobutyl-N-(3-hydroxypropyl)-1-benzofuran-2-carboxamide is O=C(c1cc2ccccc2o1)N(CCCO)C1CCC1.
What is the InChIKey of N-cyclobutyl-N-(3-hydroxypropyl)-1-benzofuran-2-carboxamide?
The InChIKey is PBNAGCDPJACXIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO3/c18-10-4-9-17(13-6-3-7-13)16(19)15-11-12-5-1-2-8-14(12)20-15/h1-2,5,8,11,13,18H,3-4,6-7,9-10H2.
What are the key properties of N-cyclobutyl-N-(3-hydroxypropyl)-1-benzofuran-2-carboxamide?
N-cyclobutyl-N-(3-hydroxypropyl)-1-benzofuran-2-carboxamide has a molecular weight of 273.33 g/mol, XLogP of 2.81, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclobutyl-N-(3-hydroxypropyl)-1-benzofuran-2-carboxamide is sourced from PubChem (CID 102866226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).