(2-amino-1-methylcyclopentyl)-(7-methyl-1-benzofuran-2-yl)methanone

C16H19NO2 — CID 114737310

IUPAC(2-amino-1-methylcyclopentyl)-(7-methyl-1-benzofuran-2-yl)methanone
SMILESCc1cccc2cc(C(=O)C3(C)CCCC3N)oc12
InChIInChI=1S/C16H19NO2/c1-10-5-3-6-11-9-12(19-14(10)11)15(18)16(2)8-4-7-13(16)17/h3,5-6,9,13H,4,7-8,17H2,1-2H3
InChIKeyMXCBPYIEUYJMHH-UHFFFAOYSA-N
MW257.33 g/mol
LogP3.44
Rot. Bonds2

About (2-amino-1-methylcyclopentyl)-(7-methyl-1-benzofuran-2-yl)methanone

(2-amino-1-methylcyclopentyl)-(7-methyl-1-benzofuran-2-yl)methanone (PubChem CID 114737310) has the molecular formula C16H19NO2 and a molecular weight of 257.33 g/mol. Its IUPAC name is (2-amino-1-methylcyclopentyl)-(7-methyl-1-benzofuran-2-yl)methanone.

Molecular Properties

Compound Name(2-amino-1-methylcyclopentyl)-(7-methyl-1-benzofuran-2-yl)methanone
PubChem CID114737310
Molecular FormulaC16H19NO2
Molecular Weight257.33 g/mol
Exact Mass257.14
IUPAC Name(2-amino-1-methylcyclopentyl)-(7-methyl-1-benzofuran-2-yl)methanone
SMILESCc1cccc2cc(C(=O)C3(C)CCCC3N)oc12
InChIInChI=1S/C16H19NO2/c1-10-5-3-6-11-9-12(19-14(10)11)15(18)16(2)8-4-7-13(16)17/h3,5-6,9,13H,4,7-8,17H2,1-2H3
InChIKeyMXCBPYIEUYJMHH-UHFFFAOYSA-N
XLogP3.44
TPSA56.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2-amino-1-methylcyclopentyl)-(7-methyl-1-benzofuran-2-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-aminocyclohexyl)-(7-methyl-1-benzofuran-2-yl)methanone
CID 114736196
[1-(dimethylamino)cyclohexyl]-(7-methyl-1-benzofuran-2-yl)methanone
CID 114725657
2-cyclohexyl-1-(7-methyl-1-benzofuran-2-yl)ethanone
CID 115808413
1-(7-methyl-1-benzofuran-2-yl)ethanone
CID 14468440
(2-amino-1-methylcyclopentyl)-(3-chloro-4-methylphenyl)methanone
CID 107561390
(2-amino-1-methylcyclopentyl)-(3-propylphenyl)methanone
CID 116607279
2-[1-(aminomethyl)cyclohexyl]-1-(7-methyl-1-benzofuran-2-yl)ethanone
CID 114737417
1-(7-methyl-1-benzofuran-2-yl)-2-piperidin-4-ylethanone
CID 114736371
2-[1-[(7-methyl-1-benzofuran-2-carbonyl)amino]cyclobutyl]acetic acid
CID 119217742
(2,2-dimethylcyclopentyl)-(7-methyl-1-benzofuran-2-yl)methanamine
CID 107191137
2,3-dimethyl-1-(7-methyl-1-benzofuran-2-yl)cyclohexan-1-ol
CID 114723887
(2,2-dimethylcyclopentyl)-(7-fluoro-1-benzofuran-2-yl)methanone
CID 107187565

Frequently Asked Questions

What is the IUPAC name of (2-amino-1-methylcyclopentyl)-(7-methyl-1-benzofuran-2-yl)methanone?
The IUPAC name of (2-amino-1-methylcyclopentyl)-(7-methyl-1-benzofuran-2-yl)methanone (CID 114737310) is (2-amino-1-methylcyclopentyl)-(7-methyl-1-benzofuran-2-yl)methanone.
What is the SMILES notation for (2-amino-1-methylcyclopentyl)-(7-methyl-1-benzofuran-2-yl)methanone?
The canonical SMILES for (2-amino-1-methylcyclopentyl)-(7-methyl-1-benzofuran-2-yl)methanone is Cc1cccc2cc(C(=O)C3(C)CCCC3N)oc12.
What is the InChIKey of (2-amino-1-methylcyclopentyl)-(7-methyl-1-benzofuran-2-yl)methanone?
The InChIKey is MXCBPYIEUYJMHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO2/c1-10-5-3-6-11-9-12(19-14(10)11)15(18)16(2)8-4-7-13(16)17/h3,5-6,9,13H,4,7-8,17H2,1-2H3.
What are the key properties of (2-amino-1-methylcyclopentyl)-(7-methyl-1-benzofuran-2-yl)methanone?
(2-amino-1-methylcyclopentyl)-(7-methyl-1-benzofuran-2-yl)methanone has a molecular weight of 257.33 g/mol, XLogP of 3.44, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-1-methylcyclopentyl)-(7-methyl-1-benzofuran-2-yl)methanone is sourced from PubChem (CID 114737310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).