2-(butan-2-ylamino)-N-(2,3-dihydro-1H-inden-2-yl)acetamide

C15H22N2O — CID 114007934

IUPAC2-(butan-2-ylamino)-N-(2,3-dihydro-1H-inden-2-yl)acetamide
SMILESCCC(C)NCC(=O)NC1Cc2ccccc2C1
InChIInChI=1S/C15H22N2O/c1-3-11(2)16-10-15(18)17-14-8-12-6-4-5-7-13(12)9-14/h4-7,11,14,16H,3,8-10H2,1-2H3,(H,17,18)
InChIKeyYGLMTQBBLIMQBE-UHFFFAOYSA-N
MW246.35 g/mol
LogP1.66
Rot. Bonds5

About 2-(butan-2-ylamino)-N-(2,3-dihydro-1H-inden-2-yl)acetamide

2-(butan-2-ylamino)-N-(2,3-dihydro-1H-inden-2-yl)acetamide (PubChem CID 114007934) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is 2-(butan-2-ylamino)-N-(2,3-dihydro-1H-inden-2-yl)acetamide.

Molecular Properties

Compound Name2-(butan-2-ylamino)-N-(2,3-dihydro-1H-inden-2-yl)acetamide
PubChem CID114007934
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name2-(butan-2-ylamino)-N-(2,3-dihydro-1H-inden-2-yl)acetamide
SMILESCCC(C)NCC(=O)NC1Cc2ccccc2C1
InChIInChI=1S/C15H22N2O/c1-3-11(2)16-10-15(18)17-14-8-12-6-4-5-7-13(12)9-14/h4-7,11,14,16H,3,8-10H2,1-2H3,(H,17,18)
InChIKeyYGLMTQBBLIMQBE-UHFFFAOYSA-N
XLogP1.66
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(butan-2-ylamino)-N-(2,3-dihydro-1H-inden-2-yl)acetamide?
The IUPAC name of 2-(butan-2-ylamino)-N-(2,3-dihydro-1H-inden-2-yl)acetamide (CID 114007934) is 2-(butan-2-ylamino)-N-(2,3-dihydro-1H-inden-2-yl)acetamide.
What is the SMILES notation for 2-(butan-2-ylamino)-N-(2,3-dihydro-1H-inden-2-yl)acetamide?
The canonical SMILES for 2-(butan-2-ylamino)-N-(2,3-dihydro-1H-inden-2-yl)acetamide is CCC(C)NCC(=O)NC1Cc2ccccc2C1.
What is the InChIKey of 2-(butan-2-ylamino)-N-(2,3-dihydro-1H-inden-2-yl)acetamide?
The InChIKey is YGLMTQBBLIMQBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-3-11(2)16-10-15(18)17-14-8-12-6-4-5-7-13(12)9-14/h4-7,11,14,16H,3,8-10H2,1-2H3,(H,17,18).
What are the key properties of 2-(butan-2-ylamino)-N-(2,3-dihydro-1H-inden-2-yl)acetamide?
2-(butan-2-ylamino)-N-(2,3-dihydro-1H-inden-2-yl)acetamide has a molecular weight of 246.35 g/mol, XLogP of 1.66, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(butan-2-ylamino)-N-(2,3-dihydro-1H-inden-2-yl)acetamide is sourced from PubChem (CID 114007934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).