1-benzofuran-2-yl-[2-(methylaminomethyl)pyrrolidin-1-yl]methanone

C15H18N2O2 — CID 81484568

IUPAC1-benzofuran-2-yl-[2-(methylaminomethyl)pyrrolidin-1-yl]methanone
SMILESCNCC1CCCN1C(=O)c1cc2ccccc2o1
InChIInChI=1S/C15H18N2O2/c1-16-10-12-6-4-8-17(12)15(18)14-9-11-5-2-3-7-13(11)19-14/h2-3,5,7,9,12,16H,4,6,8,10H2,1H3
InChIKeyKXOIUUWSCPOGSU-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.26
Rot. Bonds3

About 1-benzofuran-2-yl-[2-(methylaminomethyl)pyrrolidin-1-yl]methanone

1-benzofuran-2-yl-[2-(methylaminomethyl)pyrrolidin-1-yl]methanone (PubChem CID 81484568) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is 1-benzofuran-2-yl-[2-(methylaminomethyl)pyrrolidin-1-yl]methanone.

Molecular Properties

Compound Name1-benzofuran-2-yl-[2-(methylaminomethyl)pyrrolidin-1-yl]methanone
PubChem CID81484568
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Name1-benzofuran-2-yl-[2-(methylaminomethyl)pyrrolidin-1-yl]methanone
SMILESCNCC1CCCN1C(=O)c1cc2ccccc2o1
InChIInChI=1S/C15H18N2O2/c1-16-10-12-6-4-8-17(12)15(18)14-9-11-5-2-3-7-13(11)19-14/h2-3,5,7,9,12,16H,4,6,8,10H2,1H3
InChIKeyKXOIUUWSCPOGSU-UHFFFAOYSA-N
XLogP2.26
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-benzofuran-2-yl-[2-(methylaminomethyl)pyrrolidin-1-yl]methanone 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

1-benzofuran-2-yl-[(2R)-2-[(3,5-dimethylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methanone
CID 95605865
1-benzofuran-2-yl-[4-(methylaminomethyl)piperidin-1-yl]methanone
CID 63248546
1-benzofuran-2-yl-[(2R)-2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methanone
CID 95351459
1-benzofuran-2-yl-[(2S)-2-(triazol-1-ylmethyl)pyrrolidin-1-yl]methanone
CID 120949540
furan-2-yl-[2-(methylaminomethyl)pyrrolidin-1-yl]methanone;hydrochloride
CID 119651190
1-benzofuran-2-yl-[3-(methylaminomethyl)pyrrolidin-1-yl]methanone
CID 63263992
[2-(methylaminomethyl)pyrrolidin-1-yl]-(3-phenyl-1,2-oxazol-5-yl)methanone
CID 119651558
[2-(methylaminomethyl)pyrrolidin-1-yl]-(5-phenoxyfuran-2-yl)methanone
CID 119650375
(3-hydroxyphenyl)-[2-(methylaminomethyl)pyrrolidin-1-yl]methanone
CID 113285249
(5-chlorofuran-2-yl)-[2-(methylaminomethyl)pyrrolidin-1-yl]methanone;hydrochloride
CID 119651425
1-[4-(1-benzofuran-2-carbonyl)-3,3a,5,6,7,7a-hexahydro-2H-pyrrolo[3,2-b]pyridin-1-yl]prop-2-en-1-one
CID 172889664
[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-(5-methyl-1-benzofuran-2-yl)methanone
CID 66261699

Frequently Asked Questions

What is the IUPAC name of 1-benzofuran-2-yl-[2-(methylaminomethyl)pyrrolidin-1-yl]methanone?
The IUPAC name of 1-benzofuran-2-yl-[2-(methylaminomethyl)pyrrolidin-1-yl]methanone (CID 81484568) is 1-benzofuran-2-yl-[2-(methylaminomethyl)pyrrolidin-1-yl]methanone.
What is the SMILES notation for 1-benzofuran-2-yl-[2-(methylaminomethyl)pyrrolidin-1-yl]methanone?
The canonical SMILES for 1-benzofuran-2-yl-[2-(methylaminomethyl)pyrrolidin-1-yl]methanone is CNCC1CCCN1C(=O)c1cc2ccccc2o1.
What is the InChIKey of 1-benzofuran-2-yl-[2-(methylaminomethyl)pyrrolidin-1-yl]methanone?
The InChIKey is KXOIUUWSCPOGSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-16-10-12-6-4-8-17(12)15(18)14-9-11-5-2-3-7-13(11)19-14/h2-3,5,7,9,12,16H,4,6,8,10H2,1H3.
What are the key properties of 1-benzofuran-2-yl-[2-(methylaminomethyl)pyrrolidin-1-yl]methanone?
1-benzofuran-2-yl-[2-(methylaminomethyl)pyrrolidin-1-yl]methanone has a molecular weight of 258.32 g/mol, XLogP of 2.26, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzofuran-2-yl-[2-(methylaminomethyl)pyrrolidin-1-yl]methanone is sourced from PubChem (CID 81484568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).