N-(2,3-dihydro-1H-inden-1-yl)-2-(dipropylamino)acetamide;hydrochloride

C17H27ClN2O — CID 3055387

IUPACN-(2,3-dihydro-1H-inden-1-yl)-2-(dipropylamino)acetamide;hydrochloride
SMILESCCCN(CCC)CC(=O)NC1CCc2ccccc21.Cl
InChIInChI=1S/C17H26N2O.ClH/c1-3-11-19(12-4-2)13-17(20)18-16-10-9-14-7-5-6-8-15(14)16;/h5-8,16H,3-4,9-13H2,1-2H3,(H,18,20);1H
InChIKeyRBKAHBDUBCYBRG-UHFFFAOYSA-N
MW310.87 g/mol
LogP3.33
Rot. Bonds7

About N-(2,3-dihydro-1H-inden-1-yl)-2-(dipropylamino)acetamide;hydrochloride

N-(2,3-dihydro-1H-inden-1-yl)-2-(dipropylamino)acetamide;hydrochloride (PubChem CID 3055387) has the molecular formula C17H27ClN2O and a molecular weight of 310.87 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-inden-1-yl)-2-(dipropylamino)acetamide;hydrochloride.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-inden-1-yl)-2-(dipropylamino)acetamide;hydrochloride
PubChem CID3055387
Molecular FormulaC17H27ClN2O
Molecular Weight310.87 g/mol
Exact Mass310.18
IUPAC NameN-(2,3-dihydro-1H-inden-1-yl)-2-(dipropylamino)acetamide;hydrochloride
SMILESCCCN(CCC)CC(=O)NC1CCc2ccccc21.Cl
InChIInChI=1S/C17H26N2O.ClH/c1-3-11-19(12-4-2)13-17(20)18-16-10-9-14-7-5-6-8-15(14)16;/h5-8,16H,3-4,9-13H2,1-2H3,(H,18,20);1H
InChIKeyRBKAHBDUBCYBRG-UHFFFAOYSA-N
XLogP3.33
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.87
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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Acetamide, 2-(diethylamino)-N-(phenylmethyl)-
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2-(Diethylamino)-N-(1-phenylethyl)ethanimidic acid
CID 209462
(2S)-N-[(1R)-2,3-dihydro-1H-inden-1-yl]-1-[(2S)-3,3-dimethyl-2-[(2S)-2-(methylamino)propanamido]butanoyl]pyrrolidine-2-carboxamide
CID 11166263
(2S)-1-[(2S)-3,3-dimethyl-2-[(2S)-2-(methylamino)propanamido]butanoyl]-N-(9H-fluoren-9-yl)pyrrolidine-2-carboxamide
CID 11236902
(2S)-N-[(1S)-2,3-dihydro-1H-inden-1-yl]-1-[(2S)-3,3-dimethyl-2-[(2S)-2-(methylamino)propanamido]butanoyl]pyrrolidine-2-carboxamide
CID 11750738
N-[2-(1-benzylpiperidin-4-yl)ethyl]-2-(2,3-dihydro-1H-inden-1-ylamino)acetamide
CID 23644771
(3S,6S,10aS)-N-[(1R)-2,3-dihydro-1H-inden-1-yl]-6-[(2S)-2-(methylamino)propanamido]-5-oxo-decahydropyrrolo[1,2-a]azocine-3-carboxamide
CID 25138071

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-inden-1-yl)-2-(dipropylamino)acetamide;hydrochloride?
The IUPAC name of N-(2,3-dihydro-1H-inden-1-yl)-2-(dipropylamino)acetamide;hydrochloride (CID 3055387) is N-(2,3-dihydro-1H-inden-1-yl)-2-(dipropylamino)acetamide;hydrochloride.
What is the SMILES notation for N-(2,3-dihydro-1H-inden-1-yl)-2-(dipropylamino)acetamide;hydrochloride?
The canonical SMILES for N-(2,3-dihydro-1H-inden-1-yl)-2-(dipropylamino)acetamide;hydrochloride is CCCN(CCC)CC(=O)NC1CCc2ccccc21.Cl.
What is the InChIKey of N-(2,3-dihydro-1H-inden-1-yl)-2-(dipropylamino)acetamide;hydrochloride?
The InChIKey is RBKAHBDUBCYBRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O.ClH/c1-3-11-19(12-4-2)13-17(20)18-16-10-9-14-7-5-6-8-15(14)16;/h5-8,16H,3-4,9-13H2,1-2H3,(H,18,20);1H.
What are the key properties of N-(2,3-dihydro-1H-inden-1-yl)-2-(dipropylamino)acetamide;hydrochloride?
N-(2,3-dihydro-1H-inden-1-yl)-2-(dipropylamino)acetamide;hydrochloride has a molecular weight of 310.87 g/mol, XLogP of 3.33, 7 rotatable bonds, 1 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)-2-(dipropylamino)acetamide;hydrochloride is sourced from PubChem (CID 3055387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).