N-[2-(6-propoxy-2,3-dihydro-1H-inden-1-yl)ethyl]propanamide

C17H25NO2 — CID 10912753

IUPACN-[2-(6-propoxy-2,3-dihydro-1H-inden-1-yl)ethyl]propanamide
SMILESCCCOc1ccc2c(c1)C(CCNC(=O)CC)CC2
InChIInChI=1S/C17H25NO2/c1-3-11-20-15-8-7-13-5-6-14(16(13)12-15)9-10-18-17(19)4-2/h7-8,12,14H,3-6,9-11H2,1-2H3,(H,18,19)
InChIKeyGRJKFHHADKICLF-UHFFFAOYSA-N
MW275.39 g/mol
LogP3.42
Rot. Bonds7

About N-[2-(6-propoxy-2,3-dihydro-1H-inden-1-yl)ethyl]propanamide

N-[2-(6-propoxy-2,3-dihydro-1H-inden-1-yl)ethyl]propanamide (PubChem CID 10912753) has the molecular formula C17H25NO2 and a molecular weight of 275.39 g/mol. Its IUPAC name is N-[2-(6-propoxy-2,3-dihydro-1H-inden-1-yl)ethyl]propanamide.

Molecular Properties

Compound NameN-[2-(6-propoxy-2,3-dihydro-1H-inden-1-yl)ethyl]propanamide
PubChem CID10912753
Molecular FormulaC17H25NO2
Molecular Weight275.39 g/mol
Exact Mass275.19
IUPAC NameN-[2-(6-propoxy-2,3-dihydro-1H-inden-1-yl)ethyl]propanamide
SMILESCCCOc1ccc2c(c1)C(CCNC(=O)CC)CC2
InChIInChI=1S/C17H25NO2/c1-3-11-20-15-8-7-13-5-6-14(16(13)12-15)9-10-18-17(19)4-2/h7-8,12,14H,3-6,9-11H2,1-2H3,(H,18,19)
InChIKeyGRJKFHHADKICLF-UHFFFAOYSA-N
XLogP3.42
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.39
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(6-methyl-2,3-dihydro-1H-inden-1-yl)ethyl]propanamide
CID 143796011
N-[2-[6-(4-phenylbutoxy)-2,3-dihydro-1H-inden-1-yl]ethyl]acetamide
CID 25271168
N-[2-[(1S)-6-methoxy-2,3-dihydro-1H-inden-1-yl]ethyl]-2-oxopropanamide
CID 142703369
N-[2-[(1S)-6-methoxy-2,3-dihydro-1H-inden-1-yl]ethyl]-2-methylpropanamide
CID 54317020
methyl 3-[2-(butanoylamino)ethyl]-2,3-dihydro-1H-indene-5-carboxylate
CID 22922688
N-[2-(5-methoxy-2,3-dihydro-1H-inden-1-yl)ethyl]butanamide
CID 22922665
N-[2-[(1S)-5-fluoro-6-prop-2-enoxy-2,3-dihydro-1H-inden-1-yl]ethyl]propanamide
CID 69201550
N-ethyl-2-[4-(6-propoxy-2,3-dihydro-1H-inden-1-yl)piperazin-1-yl]acetamide
CID 139706623
N-[2-[(1R)-7-methyl-1,2,3,4-tetrahydronaphthalen-1-yl]ethyl]butanamide
CID 67629054
N-[2-(5-methoxy-2,3-dihydro-1H-inden-1-yl)ethyl]acetamide
CID 22922683
2-(2,3-dihydro-1H-inden-1-yl)-N-[2-(3-methylphenoxy)ethyl]acetamide
CID 86955365
N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]butanamide
CID 113101532

Frequently Asked Questions

What is the IUPAC name of N-[2-(6-propoxy-2,3-dihydro-1H-inden-1-yl)ethyl]propanamide?
The IUPAC name of N-[2-(6-propoxy-2,3-dihydro-1H-inden-1-yl)ethyl]propanamide (CID 10912753) is N-[2-(6-propoxy-2,3-dihydro-1H-inden-1-yl)ethyl]propanamide.
What is the SMILES notation for N-[2-(6-propoxy-2,3-dihydro-1H-inden-1-yl)ethyl]propanamide?
The canonical SMILES for N-[2-(6-propoxy-2,3-dihydro-1H-inden-1-yl)ethyl]propanamide is CCCOc1ccc2c(c1)C(CCNC(=O)CC)CC2.
What is the InChIKey of N-[2-(6-propoxy-2,3-dihydro-1H-inden-1-yl)ethyl]propanamide?
The InChIKey is GRJKFHHADKICLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO2/c1-3-11-20-15-8-7-13-5-6-14(16(13)12-15)9-10-18-17(19)4-2/h7-8,12,14H,3-6,9-11H2,1-2H3,(H,18,19).
What are the key properties of N-[2-(6-propoxy-2,3-dihydro-1H-inden-1-yl)ethyl]propanamide?
N-[2-(6-propoxy-2,3-dihydro-1H-inden-1-yl)ethyl]propanamide has a molecular weight of 275.39 g/mol, XLogP of 3.42, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(6-propoxy-2,3-dihydro-1H-inden-1-yl)ethyl]propanamide is sourced from PubChem (CID 10912753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).