2-(2,3-dihydro-1H-inden-1-ylamino)-1-piperidin-1-ylethanone

C16H22N2O — CID 43411240

IUPAC2-(2,3-dihydro-1H-inden-1-ylamino)-1-piperidin-1-ylethanone
SMILESO=C(CNC1CCc2ccccc21)N1CCCCC1
InChIInChI=1S/C16H22N2O/c19-16(18-10-4-1-5-11-18)12-17-15-9-8-13-6-2-3-7-14(13)15/h2-3,6-7,15,17H,1,4-5,8-12H2
InChIKeyMVVWPMUBQMKYDY-UHFFFAOYSA-N
MW258.36 g/mol
LogP2.28
Rot. Bonds3

About 2-(2,3-dihydro-1H-inden-1-ylamino)-1-piperidin-1-ylethanone

2-(2,3-dihydro-1H-inden-1-ylamino)-1-piperidin-1-ylethanone (PubChem CID 43411240) has the molecular formula C16H22N2O and a molecular weight of 258.36 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-inden-1-ylamino)-1-piperidin-1-ylethanone.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-inden-1-ylamino)-1-piperidin-1-ylethanone
PubChem CID43411240
Molecular FormulaC16H22N2O
Molecular Weight258.36 g/mol
Exact Mass258.17
IUPAC Name2-(2,3-dihydro-1H-inden-1-ylamino)-1-piperidin-1-ylethanone
SMILESO=C(CNC1CCc2ccccc21)N1CCCCC1
InChIInChI=1S/C16H22N2O/c19-16(18-10-4-1-5-11-18)12-17-15-9-8-13-6-2-3-7-14(13)15/h2-3,6-7,15,17H,1,4-5,8-12H2
InChIKeyMVVWPMUBQMKYDY-UHFFFAOYSA-N
XLogP2.28
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-piperidin-1-yl-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)ethanone
CID 43410641
2-(2,3-dihydro-1H-inden-1-ylamino)-1-morpholin-4-ylethanone
CID 43411223
2-(3,4-dihydro-1H-isochromen-4-ylamino)-1-piperidin-1-ylethanone
CID 107149625
2-[[(1S)-2,3-dihydro-1H-inden-1-yl]amino]acetic acid
CID 13100819
2-[[(1S)-2,3-dihydro-1H-inden-1-yl]amino]acetic acid;hydrochloride
CID 22976313
2-(2,3-dihydro-1H-inden-1-ylamino)-1-piperidin-1-ylpropan-1-one
CID 43411283
N-butan-2-yl-2-(2,3-dihydro-1H-inden-1-ylamino)acetamide
CID 43424190
2-(2,3-dihydro-1H-inden-1-ylamino)-N,N-dimethylacetamide
CID 43215159
1-(2,3-dihydro-1H-inden-1-ylamino)-3-pyrrolidin-1-ylpropan-2-ol
CID 60729065
2-(2,3-dihydro-1H-inden-1-ylamino)-N-(2,2,2-trifluoroethyl)acetamide
CID 60702700
3-(2,3-dihydro-1H-inden-1-ylamino)propanoic acid
CID 43088449
N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine-1-carboxamide
CID 54412767

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-inden-1-ylamino)-1-piperidin-1-ylethanone?
The IUPAC name of 2-(2,3-dihydro-1H-inden-1-ylamino)-1-piperidin-1-ylethanone (CID 43411240) is 2-(2,3-dihydro-1H-inden-1-ylamino)-1-piperidin-1-ylethanone.
What is the SMILES notation for 2-(2,3-dihydro-1H-inden-1-ylamino)-1-piperidin-1-ylethanone?
The canonical SMILES for 2-(2,3-dihydro-1H-inden-1-ylamino)-1-piperidin-1-ylethanone is O=C(CNC1CCc2ccccc21)N1CCCCC1.
What is the InChIKey of 2-(2,3-dihydro-1H-inden-1-ylamino)-1-piperidin-1-ylethanone?
The InChIKey is MVVWPMUBQMKYDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O/c19-16(18-10-4-1-5-11-18)12-17-15-9-8-13-6-2-3-7-14(13)15/h2-3,6-7,15,17H,1,4-5,8-12H2.
What are the key properties of 2-(2,3-dihydro-1H-inden-1-ylamino)-1-piperidin-1-ylethanone?
2-(2,3-dihydro-1H-inden-1-ylamino)-1-piperidin-1-ylethanone has a molecular weight of 258.36 g/mol, XLogP of 2.28, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-inden-1-ylamino)-1-piperidin-1-ylethanone is sourced from PubChem (CID 43411240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).