N-[2-[(1S)-6-methoxy-2,3-dihydro-1H-inden-1-yl]ethyl]acetamide

C14H19NO2 — CID 10988162

IUPACN-[2-[(1S)-6-methoxy-2,3-dihydro-1H-inden-1-yl]ethyl]acetamide
SMILESCOc1ccc2c(c1)[C@H](CCNC(C)=O)CC2
InChIInChI=1S/C14H19NO2/c1-10(16)15-8-7-12-4-3-11-5-6-13(17-2)9-14(11)12/h5-6,9,12H,3-4,7-8H2,1-2H3,(H,15,16)/t12-/m0/s1
InChIKeyUOVGAGSCHHZUPU-LBPRGKRZSA-N
MW233.31 g/mol
LogP2.25
Rot. Bonds4

About N-[2-[(1S)-6-methoxy-2,3-dihydro-1H-inden-1-yl]ethyl]acetamide

N-[2-[(1S)-6-methoxy-2,3-dihydro-1H-inden-1-yl]ethyl]acetamide (PubChem CID 10988162) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is N-[2-[(1S)-6-methoxy-2,3-dihydro-1H-inden-1-yl]ethyl]acetamide.

Molecular Properties

Compound NameN-[2-[(1S)-6-methoxy-2,3-dihydro-1H-inden-1-yl]ethyl]acetamide
PubChem CID10988162
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC NameN-[2-[(1S)-6-methoxy-2,3-dihydro-1H-inden-1-yl]ethyl]acetamide
SMILESCOc1ccc2c(c1)[C@H](CCNC(C)=O)CC2
InChIInChI=1S/C14H19NO2/c1-10(16)15-8-7-12-4-3-11-5-6-13(17-2)9-14(11)12/h5-6,9,12H,3-4,7-8H2,1-2H3,(H,15,16)/t12-/m0/s1
InChIKeyUOVGAGSCHHZUPU-LBPRGKRZSA-N
XLogP2.25
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[2-[(1S)-6-methoxy-2,3-dihydro-1H-inden-1-yl]ethyl]acetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[2-[(1S)-6-methoxy-2,3-dihydro-1H-inden-1-yl]ethyl]acetamide?
The IUPAC name of N-[2-[(1S)-6-methoxy-2,3-dihydro-1H-inden-1-yl]ethyl]acetamide (CID 10988162) is N-[2-[(1S)-6-methoxy-2,3-dihydro-1H-inden-1-yl]ethyl]acetamide.
What is the SMILES notation for N-[2-[(1S)-6-methoxy-2,3-dihydro-1H-inden-1-yl]ethyl]acetamide?
The canonical SMILES for N-[2-[(1S)-6-methoxy-2,3-dihydro-1H-inden-1-yl]ethyl]acetamide is COc1ccc2c(c1)[C@H](CCNC(C)=O)CC2.
What is the InChIKey of N-[2-[(1S)-6-methoxy-2,3-dihydro-1H-inden-1-yl]ethyl]acetamide?
The InChIKey is UOVGAGSCHHZUPU-LBPRGKRZSA-N. The full InChI is InChI=1S/C14H19NO2/c1-10(16)15-8-7-12-4-3-11-5-6-13(17-2)9-14(11)12/h5-6,9,12H,3-4,7-8H2,1-2H3,(H,15,16)/t12-/m0/s1.
What are the key properties of N-[2-[(1S)-6-methoxy-2,3-dihydro-1H-inden-1-yl]ethyl]acetamide?
N-[2-[(1S)-6-methoxy-2,3-dihydro-1H-inden-1-yl]ethyl]acetamide has a molecular weight of 233.31 g/mol, XLogP of 2.25, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(1S)-6-methoxy-2,3-dihydro-1H-inden-1-yl]ethyl]acetamide is sourced from PubChem (CID 10988162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).