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

C14H19NO2 — CID 11117958

IUPACN-[2-[(1R)-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-/m1/s1
InChIKeyUOVGAGSCHHZUPU-GFCCVEGCSA-N
MW233.31 g/mol
LogP2.25
Rot. Bonds4

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

N-[2-[(1R)-6-methoxy-2,3-dihydro-1H-inden-1-yl]ethyl]acetamide (PubChem CID 11117958) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is N-[2-[(1R)-6-methoxy-2,3-dihydro-1H-inden-1-yl]ethyl]acetamide.

Molecular Properties

Compound NameN-[2-[(1R)-6-methoxy-2,3-dihydro-1H-inden-1-yl]ethyl]acetamide
PubChem CID11117958
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC NameN-[2-[(1R)-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-/m1/s1
InChIKeyUOVGAGSCHHZUPU-GFCCVEGCSA-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

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Related Compounds

Agomelatine
CID 82148
Ramelteon
CID 208902
Tasimelteon
CID 10220503
Motretinide
CID 6314185
N-(2-(1,6,7,8-Tetrahydro-2H-indeno(5,4-b)furan-8-yl)ethyl)propanamide
CID 9881626
Propanamide, N-(2-(7-methoxy-1-naphthalenyl)ethyl)-
CID 3071631
Butanamide, N-(2-(7-methoxy-1-naphthalenyl)ethyl)-
CID 3071652
N-[3-(3-methoxyphenyl)propyl]acetamide
CID 10750842
N-[(6-Methoxy-9-tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaenyl)methyl]acetamide
CID 11185529
Cifea
CID 53238181
Propanamide, N-(2-(7-methoxy-1-naphthalenyl)ethyl)-2-methyl-
CID 3071630
N-(2-(4-methoxyphenyl)ethyl)pentanamide
CID 1769471

Frequently Asked Questions

What is the IUPAC name of N-[2-[(1R)-6-methoxy-2,3-dihydro-1H-inden-1-yl]ethyl]acetamide?
The IUPAC name of N-[2-[(1R)-6-methoxy-2,3-dihydro-1H-inden-1-yl]ethyl]acetamide (CID 11117958) is N-[2-[(1R)-6-methoxy-2,3-dihydro-1H-inden-1-yl]ethyl]acetamide.
What is the SMILES notation for N-[2-[(1R)-6-methoxy-2,3-dihydro-1H-inden-1-yl]ethyl]acetamide?
The canonical SMILES for N-[2-[(1R)-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-[(1R)-6-methoxy-2,3-dihydro-1H-inden-1-yl]ethyl]acetamide?
The InChIKey is UOVGAGSCHHZUPU-GFCCVEGCSA-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-/m1/s1.
What are the key properties of N-[2-[(1R)-6-methoxy-2,3-dihydro-1H-inden-1-yl]ethyl]acetamide?
N-[2-[(1R)-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-[(1R)-6-methoxy-2,3-dihydro-1H-inden-1-yl]ethyl]acetamide is sourced from PubChem (CID 11117958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).