N-(3-hydroxypropyl)-2-piperidin-1-yl-1,3-dihydroindene-2-carboxamide

C18H26N2O2 — CID 56899775

IUPACN-(3-hydroxypropyl)-2-piperidin-1-yl-1,3-dihydroindene-2-carboxamide
SMILESO=C(NCCCO)C1(N2CCCCC2)Cc2ccccc2C1
InChIInChI=1S/C18H26N2O2/c21-12-6-9-19-17(22)18(20-10-4-1-5-11-20)13-15-7-2-3-8-16(15)14-18/h2-3,7-8,21H,1,4-6,9-14H2,(H,19,22)
InChIKeyDITQJJOBBFRZBD-UHFFFAOYSA-N
MW302.42 g/mol
LogP1.51
Rot. Bonds5

About N-(3-hydroxypropyl)-2-piperidin-1-yl-1,3-dihydroindene-2-carboxamide

N-(3-hydroxypropyl)-2-piperidin-1-yl-1,3-dihydroindene-2-carboxamide (PubChem CID 56899775) has the molecular formula C18H26N2O2 and a molecular weight of 302.42 g/mol. Its IUPAC name is N-(3-hydroxypropyl)-2-piperidin-1-yl-1,3-dihydroindene-2-carboxamide.

Molecular Properties

Compound NameN-(3-hydroxypropyl)-2-piperidin-1-yl-1,3-dihydroindene-2-carboxamide
PubChem CID56899775
Molecular FormulaC18H26N2O2
Molecular Weight302.42 g/mol
Exact Mass302.20
IUPAC NameN-(3-hydroxypropyl)-2-piperidin-1-yl-1,3-dihydroindene-2-carboxamide
SMILESO=C(NCCCO)C1(N2CCCCC2)Cc2ccccc2C1
InChIInChI=1S/C18H26N2O2/c21-12-6-9-19-17(22)18(20-10-4-1-5-11-20)13-15-7-2-3-8-16(15)14-18/h2-3,7-8,21H,1,4-6,9-14H2,(H,19,22)
InChIKeyDITQJJOBBFRZBD-UHFFFAOYSA-N
XLogP1.51
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

(1R)-1'-[(2R)-2-[(2-amino-2-methylpropanoyl)amino]-5-phenylpentanoyl]-N-(2-hydroxyethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide;hydrochloride
CID 45263513
(1R)-1'-[(2R)-2-[(2-amino-2-methylpropanoyl)amino]-5-phenylpentanoyl]-N-(3-hydroxypropyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide;hydrochloride
CID 45263514
(1S)-1'-[(2R)-2-[(2-amino-2-methylpropanoyl)amino]-5-phenylpentanoyl]-N-(2-hydroxyethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide;hydrochloride
CID 45263519
(1S)-1'-[(2R)-2-[(2-amino-2-methylpropanoyl)amino]-5-phenylpentanoyl]-N-(4-hydroxybutyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide;hydrochloride
CID 45263520
(1S)-1'-[(2R)-2-[(2-amino-2-methylpropanoyl)amino]-5-phenylpentanoyl]-N-(3-hydroxypropyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide;hydrochloride
CID 45265875
(1R)-1'-[(2R)-2-[(2-amino-2-methylpropanoyl)amino]-5-phenylpentanoyl]-N-(4-hydroxybutyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-carboxamide;hydrochloride
CID 45265895
2-amino-N-[(2R)-4-cyclohexyl-1-oxo-1-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylbutan-2-yl]-2-methylpropanamide;hydrochloride
CID 22867375
2-amino-2-methyl-N-[(2R)-1-oxo-5-phenyl-1-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylpentan-2-yl]propanamide
CID 44293557
2-amino-2-methyl-N-[(2R)-1-oxo-4-phenyl-1-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylbutan-2-yl]propanamide;hydrochloride
CID 45263954
2-amino-2-methyl-N-[(2R)-1-oxo-5-phenyl-1-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylpentan-2-yl]propanamide;hydrochloride
CID 45264075
4-(9H-fluoren-9-ylacetyl)-2,6-piperazinedione
CID 867647
N-[3-[4-(3-aminopropylamino)butylamino]propyl]-2-(butanoylamino)-1,3-dihydroindene-2-carboxamide
CID 11456998

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxypropyl)-2-piperidin-1-yl-1,3-dihydroindene-2-carboxamide?
The IUPAC name of N-(3-hydroxypropyl)-2-piperidin-1-yl-1,3-dihydroindene-2-carboxamide (CID 56899775) is N-(3-hydroxypropyl)-2-piperidin-1-yl-1,3-dihydroindene-2-carboxamide.
What is the SMILES notation for N-(3-hydroxypropyl)-2-piperidin-1-yl-1,3-dihydroindene-2-carboxamide?
The canonical SMILES for N-(3-hydroxypropyl)-2-piperidin-1-yl-1,3-dihydroindene-2-carboxamide is O=C(NCCCO)C1(N2CCCCC2)Cc2ccccc2C1.
What is the InChIKey of N-(3-hydroxypropyl)-2-piperidin-1-yl-1,3-dihydroindene-2-carboxamide?
The InChIKey is DITQJJOBBFRZBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O2/c21-12-6-9-19-17(22)18(20-10-4-1-5-11-20)13-15-7-2-3-8-16(15)14-18/h2-3,7-8,21H,1,4-6,9-14H2,(H,19,22).
What are the key properties of N-(3-hydroxypropyl)-2-piperidin-1-yl-1,3-dihydroindene-2-carboxamide?
N-(3-hydroxypropyl)-2-piperidin-1-yl-1,3-dihydroindene-2-carboxamide has a molecular weight of 302.42 g/mol, XLogP of 1.51, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxypropyl)-2-piperidin-1-yl-1,3-dihydroindene-2-carboxamide is sourced from PubChem (CID 56899775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).