N-(2,3-dihydro-1H-inden-1-yl)-3-piperidin-3-ylbutanamide

C18H26N2O — CID 81047550

IUPACN-(2,3-dihydro-1H-inden-1-yl)-3-piperidin-3-ylbutanamide
SMILESCC(CC(=O)NC1CCc2ccccc21)C1CCCNC1
InChIInChI=1S/C18H26N2O/c1-13(15-6-4-10-19-12-15)11-18(21)20-17-9-8-14-5-2-3-7-16(14)17/h2-3,5,7,13,15,17,19H,4,6,8-12H2,1H3,(H,20,21)
InChIKeyQSLYVUMVLHWJHS-UHFFFAOYSA-N
MW286.42 g/mol
LogP2.82
Rot. Bonds4

About N-(2,3-dihydro-1H-inden-1-yl)-3-piperidin-3-ylbutanamide

N-(2,3-dihydro-1H-inden-1-yl)-3-piperidin-3-ylbutanamide (PubChem CID 81047550) has the molecular formula C18H26N2O and a molecular weight of 286.42 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-inden-1-yl)-3-piperidin-3-ylbutanamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-inden-1-yl)-3-piperidin-3-ylbutanamide
PubChem CID81047550
Molecular FormulaC18H26N2O
Molecular Weight286.42 g/mol
Exact Mass286.20
IUPAC NameN-(2,3-dihydro-1H-inden-1-yl)-3-piperidin-3-ylbutanamide
SMILESCC(CC(=O)NC1CCc2ccccc21)C1CCCNC1
InChIInChI=1S/C18H26N2O/c1-13(15-6-4-10-19-12-15)11-18(21)20-17-9-8-14-5-2-3-7-16(14)17/h2-3,5,7,13,15,17,19H,4,6,8-12H2,1H3,(H,20,21)
InChIKeyQSLYVUMVLHWJHS-UHFFFAOYSA-N
XLogP2.82
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-3-piperidin-3-ylbutanamide;hydrochloride
CID 119745334
3-piperidin-3-yl-N-(4,5,6,7-tetrahydro-1-benzofuran-4-yl)butanamide
CID 81048858
N-(6-fluoro-3,4-dihydro-2H-thiochromen-4-yl)-3-piperidin-3-ylbutanamide
CID 119695812
N-cyclopropyl-N-(2,3-dihydro-1H-inden-1-yl)-3-piperidin-3-ylbutanamide
CID 119742625
N-(6-fluoro-3,4-dihydro-2H-thiochromen-4-yl)-3-piperidin-3-ylbutanamide;hydrochloride
CID 119695811
3-piperidin-3-ylbutanoic acid
CID 71691534
(3S)-3-[(3S)-piperidin-3-yl]butanoic acid
CID 95732451
N-(1,2-dihydroacenaphthylen-5-yl)-3-piperidin-3-ylbutanamide
CID 119697816
N-(4-methylcyclohexyl)-3-piperidin-3-ylbutanamide
CID 81044327
N-(4-hydroxycyclohexyl)-3-piperidin-3-ylbutanamide
CID 81043560
N-(3,3-diphenylpropyl)-3-piperidin-3-ylbutanamide
CID 119675917
N-(2-hydroxy-1-phenylethyl)-3-piperidin-3-ylbutanamide
CID 81047426

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-inden-1-yl)-3-piperidin-3-ylbutanamide?
The IUPAC name of N-(2,3-dihydro-1H-inden-1-yl)-3-piperidin-3-ylbutanamide (CID 81047550) is N-(2,3-dihydro-1H-inden-1-yl)-3-piperidin-3-ylbutanamide.
What is the SMILES notation for N-(2,3-dihydro-1H-inden-1-yl)-3-piperidin-3-ylbutanamide?
The canonical SMILES for N-(2,3-dihydro-1H-inden-1-yl)-3-piperidin-3-ylbutanamide is CC(CC(=O)NC1CCc2ccccc21)C1CCCNC1.
What is the InChIKey of N-(2,3-dihydro-1H-inden-1-yl)-3-piperidin-3-ylbutanamide?
The InChIKey is QSLYVUMVLHWJHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O/c1-13(15-6-4-10-19-12-15)11-18(21)20-17-9-8-14-5-2-3-7-16(14)17/h2-3,5,7,13,15,17,19H,4,6,8-12H2,1H3,(H,20,21).
What are the key properties of N-(2,3-dihydro-1H-inden-1-yl)-3-piperidin-3-ylbutanamide?
N-(2,3-dihydro-1H-inden-1-yl)-3-piperidin-3-ylbutanamide has a molecular weight of 286.42 g/mol, XLogP of 2.82, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-inden-1-yl)-3-piperidin-3-ylbutanamide is sourced from PubChem (CID 81047550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).