N-(cyclobutylmethyl)-2-(2,3-dihydro-1H-inden-5-yloxy)butanamide

C18H25NO2 — CID 110281951

IUPACN-(cyclobutylmethyl)-2-(2,3-dihydro-1H-inden-5-yloxy)butanamide
SMILESCCC(Oc1ccc2c(c1)CCC2)C(=O)NCC1CCC1
InChIInChI=1S/C18H25NO2/c1-2-17(18(20)19-12-13-5-3-6-13)21-16-10-9-14-7-4-8-15(14)11-16/h9-11,13,17H,2-8,12H2,1H3,(H,19,20)
InChIKeyNUAOIDCJDDIGKD-UHFFFAOYSA-N
MW287.40 g/mol
LogP3.25
Rot. Bonds6

About N-(cyclobutylmethyl)-2-(2,3-dihydro-1H-inden-5-yloxy)butanamide

N-(cyclobutylmethyl)-2-(2,3-dihydro-1H-inden-5-yloxy)butanamide (PubChem CID 110281951) has the molecular formula C18H25NO2 and a molecular weight of 287.40 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-2-(2,3-dihydro-1H-inden-5-yloxy)butanamide.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-2-(2,3-dihydro-1H-inden-5-yloxy)butanamide
PubChem CID110281951
Molecular FormulaC18H25NO2
Molecular Weight287.40 g/mol
Exact Mass287.19
IUPAC NameN-(cyclobutylmethyl)-2-(2,3-dihydro-1H-inden-5-yloxy)butanamide
SMILESCCC(Oc1ccc2c(c1)CCC2)C(=O)NCC1CCC1
InChIInChI=1S/C18H25NO2/c1-2-17(18(20)19-12-13-5-3-6-13)21-16-10-9-14-7-4-8-15(14)11-16/h9-11,13,17H,2-8,12H2,1H3,(H,19,20)
InChIKeyNUAOIDCJDDIGKD-UHFFFAOYSA-N
XLogP3.25
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.40
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(cyclobutylmethyl)-2-(2,3-dihydro-1H-inden-5-yloxy)butanamide?
The IUPAC name of N-(cyclobutylmethyl)-2-(2,3-dihydro-1H-inden-5-yloxy)butanamide (CID 110281951) is N-(cyclobutylmethyl)-2-(2,3-dihydro-1H-inden-5-yloxy)butanamide.
What is the SMILES notation for N-(cyclobutylmethyl)-2-(2,3-dihydro-1H-inden-5-yloxy)butanamide?
The canonical SMILES for N-(cyclobutylmethyl)-2-(2,3-dihydro-1H-inden-5-yloxy)butanamide is CCC(Oc1ccc2c(c1)CCC2)C(=O)NCC1CCC1.
What is the InChIKey of N-(cyclobutylmethyl)-2-(2,3-dihydro-1H-inden-5-yloxy)butanamide?
The InChIKey is NUAOIDCJDDIGKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25NO2/c1-2-17(18(20)19-12-13-5-3-6-13)21-16-10-9-14-7-4-8-15(14)11-16/h9-11,13,17H,2-8,12H2,1H3,(H,19,20).
What are the key properties of N-(cyclobutylmethyl)-2-(2,3-dihydro-1H-inden-5-yloxy)butanamide?
N-(cyclobutylmethyl)-2-(2,3-dihydro-1H-inden-5-yloxy)butanamide has a molecular weight of 287.40 g/mol, XLogP of 3.25, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-2-(2,3-dihydro-1H-inden-5-yloxy)butanamide is sourced from PubChem (CID 110281951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).