1-(1-benzofuran-3-yl)-2-[cyclopropylmethyl(methyl)amino]ethanone

C15H17NO2 — CID 54884312

IUPAC1-(1-benzofuran-3-yl)-2-[cyclopropylmethyl(methyl)amino]ethanone
SMILESCN(CC(=O)c1coc2ccccc12)CC1CC1
InChIInChI=1S/C15H17NO2/c1-16(8-11-6-7-11)9-14(17)13-10-18-15-5-3-2-4-12(13)15/h2-5,10-11H,6-9H2,1H3
InChIKeyVJQRKWUTJOYLIC-UHFFFAOYSA-N
MW243.31 g/mol
LogP2.96
Rot. Bonds5

About 1-(1-benzofuran-3-yl)-2-[cyclopropylmethyl(methyl)amino]ethanone

1-(1-benzofuran-3-yl)-2-[cyclopropylmethyl(methyl)amino]ethanone (PubChem CID 54884312) has the molecular formula C15H17NO2 and a molecular weight of 243.31 g/mol. Its IUPAC name is 1-(1-benzofuran-3-yl)-2-[cyclopropylmethyl(methyl)amino]ethanone.

Molecular Properties

Compound Name1-(1-benzofuran-3-yl)-2-[cyclopropylmethyl(methyl)amino]ethanone
PubChem CID54884312
Molecular FormulaC15H17NO2
Molecular Weight243.31 g/mol
Exact Mass243.13
IUPAC Name1-(1-benzofuran-3-yl)-2-[cyclopropylmethyl(methyl)amino]ethanone
SMILESCN(CC(=O)c1coc2ccccc12)CC1CC1
InChIInChI=1S/C15H17NO2/c1-16(8-11-6-7-11)9-14(17)13-10-18-15-5-3-2-4-12(13)15/h2-5,10-11H,6-9H2,1H3
InChIKeyVJQRKWUTJOYLIC-UHFFFAOYSA-N
XLogP2.96
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-(1-benzofuran-3-yl)-2-[cyclopropylmethyl(methyl)amino]ethanone 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-(cyclopropylmethyl)-N-propyl-1-benzofuran-3-carboxamide
CID 77086659
1-(1-benzofuran-3-yl)-2-[methyl(propan-2-yl)amino]ethanone
CID 43794594
1-(1-benzofuran-3-yl)-2-[methyl(thiolan-3-yl)amino]ethanone
CID 62051384
1-(1-benzofuran-3-yl)-2-[(1,1-dioxothiolan-3-yl)-methylamino]ethanone
CID 43797742
1-(2-bromophenyl)-2-[cyclopropylmethyl(methyl)amino]ethanone
CID 60984093
1-(1-benzofuran-3-yl)-2-[(5-chlorothiophen-2-yl)methyl-methylamino]ethanone
CID 62050511
1-(1-benzofuran-3-yl)-2-[methyl-[(2-methyl-1,3-thiazol-4-yl)methyl]amino]ethanone
CID 62050875
1-(1-benzofuran-3-yl)-2-[ethyl(propan-2-yl)amino]ethanone
CID 43795122
1-(1-benzofuran-3-yl)-2-propan-2-ylsulfonylethanone
CID 64635615
CID 89242212
CID 89242212
1-(1-benzofuran-3-yl)-2-chloroethanone
CID 77174807
1-(2-bromophenyl)-2-[methyl(oxan-4-ylmethyl)amino]ethanone
CID 63713643

Frequently Asked Questions

What is the IUPAC name of 1-(1-benzofuran-3-yl)-2-[cyclopropylmethyl(methyl)amino]ethanone?
The IUPAC name of 1-(1-benzofuran-3-yl)-2-[cyclopropylmethyl(methyl)amino]ethanone (CID 54884312) is 1-(1-benzofuran-3-yl)-2-[cyclopropylmethyl(methyl)amino]ethanone.
What is the SMILES notation for 1-(1-benzofuran-3-yl)-2-[cyclopropylmethyl(methyl)amino]ethanone?
The canonical SMILES for 1-(1-benzofuran-3-yl)-2-[cyclopropylmethyl(methyl)amino]ethanone is CN(CC(=O)c1coc2ccccc12)CC1CC1.
What is the InChIKey of 1-(1-benzofuran-3-yl)-2-[cyclopropylmethyl(methyl)amino]ethanone?
The InChIKey is VJQRKWUTJOYLIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2/c1-16(8-11-6-7-11)9-14(17)13-10-18-15-5-3-2-4-12(13)15/h2-5,10-11H,6-9H2,1H3.
What are the key properties of 1-(1-benzofuran-3-yl)-2-[cyclopropylmethyl(methyl)amino]ethanone?
1-(1-benzofuran-3-yl)-2-[cyclopropylmethyl(methyl)amino]ethanone has a molecular weight of 243.31 g/mol, XLogP of 2.96, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-benzofuran-3-yl)-2-[cyclopropylmethyl(methyl)amino]ethanone is sourced from PubChem (CID 54884312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).