(2E)-N-methyl-2-(1,2,6,7-tetrahydrocyclopenta[e][1]benzofuran-8-ylidene)ethanamine

C14H17NO — CID 71141513

IUPAC(2E)-N-methyl-2-(1,2,6,7-tetrahydrocyclopenta[e][1]benzofuran-8-ylidene)ethanamine
SMILESCNC/C=C1\CCc2ccc3c(c21)CCO3
InChIInChI=1S/C14H17NO/c1-15-8-6-11-3-2-10-4-5-13-12(14(10)11)7-9-16-13/h4-6,15H,2-3,7-9H2,1H3/b11-6+
InChIKeyIFDMWRKRWRBEHN-IZZDOVSWSA-N
MW215.30 g/mol
LogP2.17
Rot. Bonds2

About (2E)-N-methyl-2-(1,2,6,7-tetrahydrocyclopenta[e][1]benzofuran-8-ylidene)ethanamine

(2E)-N-methyl-2-(1,2,6,7-tetrahydrocyclopenta[e][1]benzofuran-8-ylidene)ethanamine (PubChem CID 71141513) has the molecular formula C14H17NO and a molecular weight of 215.30 g/mol. Its IUPAC name is (2E)-N-methyl-2-(1,2,6,7-tetrahydrocyclopenta[e][1]benzofuran-8-ylidene)ethanamine.

Molecular Properties

Compound Name(2E)-N-methyl-2-(1,2,6,7-tetrahydrocyclopenta[e][1]benzofuran-8-ylidene)ethanamine
PubChem CID71141513
Molecular FormulaC14H17NO
Molecular Weight215.30 g/mol
Exact Mass215.13
IUPAC Name(2E)-N-methyl-2-(1,2,6,7-tetrahydrocyclopenta[e][1]benzofuran-8-ylidene)ethanamine
SMILESCNC/C=C1\CCc2ccc3c(c21)CCO3
InChIInChI=1S/C14H17NO/c1-15-8-6-11-3-2-10-4-5-13-12(14(10)11)7-9-16-13/h4-6,15H,2-3,7-9H2,1H3/b11-6+
InChIKeyIFDMWRKRWRBEHN-IZZDOVSWSA-N
XLogP2.17
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2E)-N-methyl-2-(1,2,6,7-tetrahydrocyclopenta[e][1]benzofuran-8-ylidene)ethanamine 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

Ramelteon
CID 208902
Ici-118551
CID 5484725
rac-(2R,3R)-1-[(7-methyl-2,3-dihydro-1H-inden-4-yl)oxy]-3-[(propan-2-yl)amino]butan-2-ol
CID 5311179
5-Apdb
CID 192601
N-(2-(1,6,7,8-Tetrahydro-2H-indeno(5,4-b)furan-8-yl)ethyl)propanamide
CID 9881626
Ici-118,551
CID 3682
Cifea
CID 53238181
N-[2-(1,6,7,8-tetrahydro-2H-indeno[5,4-b]furan-8-yl)ethyl]acetamide
CID 10890175
N-[2-(2,2-dimethyl-1,6,7,8-tetrahydrocyclopenta[e][1]benzofuran-8-yl)ethyl]propanamide
CID 11044399
N-[2-(2,6,7,8-tetrahydro-1H-cyclopenta[e][1]benzofuran-8-yl)ethyl]butanamide
CID 11780708
N-[2-(1,6-dihydro-2H-indeno[5,4-b]furan-8-yl)ethyl]acetamide
CID 22004791
N-[2-(7-Phenyl-1,6-dihydro-2H-indeno[5,4-b]furan-8-yl)-ethyl]acetamide
CID 22004862

Frequently Asked Questions

What is the IUPAC name of (2E)-N-methyl-2-(1,2,6,7-tetrahydrocyclopenta[e][1]benzofuran-8-ylidene)ethanamine?
The IUPAC name of (2E)-N-methyl-2-(1,2,6,7-tetrahydrocyclopenta[e][1]benzofuran-8-ylidene)ethanamine (CID 71141513) is (2E)-N-methyl-2-(1,2,6,7-tetrahydrocyclopenta[e][1]benzofuran-8-ylidene)ethanamine.
What is the SMILES notation for (2E)-N-methyl-2-(1,2,6,7-tetrahydrocyclopenta[e][1]benzofuran-8-ylidene)ethanamine?
The canonical SMILES for (2E)-N-methyl-2-(1,2,6,7-tetrahydrocyclopenta[e][1]benzofuran-8-ylidene)ethanamine is CNC/C=C1\CCc2ccc3c(c21)CCO3.
What is the InChIKey of (2E)-N-methyl-2-(1,2,6,7-tetrahydrocyclopenta[e][1]benzofuran-8-ylidene)ethanamine?
The InChIKey is IFDMWRKRWRBEHN-IZZDOVSWSA-N. The full InChI is InChI=1S/C14H17NO/c1-15-8-6-11-3-2-10-4-5-13-12(14(10)11)7-9-16-13/h4-6,15H,2-3,7-9H2,1H3/b11-6+.
What are the key properties of (2E)-N-methyl-2-(1,2,6,7-tetrahydrocyclopenta[e][1]benzofuran-8-ylidene)ethanamine?
(2E)-N-methyl-2-(1,2,6,7-tetrahydrocyclopenta[e][1]benzofuran-8-ylidene)ethanamine has a molecular weight of 215.30 g/mol, XLogP of 2.17, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-N-methyl-2-(1,2,6,7-tetrahydrocyclopenta[e][1]benzofuran-8-ylidene)ethanamine is sourced from PubChem (CID 71141513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).