(3-aminopiperidin-1-yl)-(2,3-dihydro-1H-inden-5-yl)methanone

C15H20N2O — CID 61298118

IUPAC(3-aminopiperidin-1-yl)-(2,3-dihydro-1H-inden-5-yl)methanone
SMILESNC1CCCN(C(=O)c2ccc3c(c2)CCC3)C1
InChIInChI=1S/C15H20N2O/c16-14-5-2-8-17(10-14)15(18)13-7-6-11-3-1-4-12(11)9-13/h6-7,9,14H,1-5,8,10,16H2
InChIKeyRATWBMBXHJMGHQ-UHFFFAOYSA-N
MW244.34 g/mol
LogP1.74
Rot. Bonds1

About (3-aminopiperidin-1-yl)-(2,3-dihydro-1H-inden-5-yl)methanone

(3-aminopiperidin-1-yl)-(2,3-dihydro-1H-inden-5-yl)methanone (PubChem CID 61298118) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is (3-aminopiperidin-1-yl)-(2,3-dihydro-1H-inden-5-yl)methanone.

Molecular Properties

Compound Name(3-aminopiperidin-1-yl)-(2,3-dihydro-1H-inden-5-yl)methanone
PubChem CID61298118
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name(3-aminopiperidin-1-yl)-(2,3-dihydro-1H-inden-5-yl)methanone
SMILESNC1CCCN(C(=O)c2ccc3c(c2)CCC3)C1
InChIInChI=1S/C15H20N2O/c16-14-5-2-8-17(10-14)15(18)13-7-6-11-3-1-4-12(11)9-13/h6-7,9,14H,1-5,8,10,16H2
InChIKeyRATWBMBXHJMGHQ-UHFFFAOYSA-N
XLogP1.74
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,3-dihydro-1H-inden-5-yl-[3-(hydroxymethyl)piperidin-1-yl]methanone
CID 43422317
[(3R)-3-aminopyrrolidin-1-yl]-(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)methanone
CID 68590313
(3-aminopiperidin-1-yl)-(3,4-dimethylphenyl)methanone;hydrochloride
CID 119381443
[3-[(3-aminopyrazin-2-yl)methyl]piperidin-1-yl]-(5,6,7,8-tetrahydronaphthalen-2-yl)methanone
CID 110113168
[(3S)-3-hydroxypyrrolidin-1-yl]-(5,6,7,8-tetrahydronaphthalen-2-yl)methanone
CID 79029502
(3-aminopiperidin-1-yl)-(1-methylsulfonyl-2,3-dihydroindol-5-yl)methanone
CID 119378639
2-[1-(2,3-dihydro-1H-indene-5-carbonyl)piperidin-4-yl]acetamide
CID 86996686
(3-aminopiperidin-1-yl)-(3-fluoro-4-methylphenyl)methanone
CID 61297571
[3-(methylaminomethyl)pyrrolidin-1-yl]-(5,6,7,8-tetrahydronaphthalen-2-yl)methanone
CID 119538624
2,3-dihydro-1H-inden-5-yl-[(3R)-3-(1H-pyrazol-5-yl)piperidin-1-yl]methanone
CID 124605887
(3-aminopiperidin-1-yl)-(3-sulfanylphenyl)methanone
CID 107023968
2,3-dihydro-1H-inden-5-yl-[(3S)-3-[(4-methyl-1H-pyrazol-5-yl)methyl]piperidin-1-yl]methanone
CID 125023698

Frequently Asked Questions

What is the IUPAC name of (3-aminopiperidin-1-yl)-(2,3-dihydro-1H-inden-5-yl)methanone?
The IUPAC name of (3-aminopiperidin-1-yl)-(2,3-dihydro-1H-inden-5-yl)methanone (CID 61298118) is (3-aminopiperidin-1-yl)-(2,3-dihydro-1H-inden-5-yl)methanone.
What is the SMILES notation for (3-aminopiperidin-1-yl)-(2,3-dihydro-1H-inden-5-yl)methanone?
The canonical SMILES for (3-aminopiperidin-1-yl)-(2,3-dihydro-1H-inden-5-yl)methanone is NC1CCCN(C(=O)c2ccc3c(c2)CCC3)C1.
What is the InChIKey of (3-aminopiperidin-1-yl)-(2,3-dihydro-1H-inden-5-yl)methanone?
The InChIKey is RATWBMBXHJMGHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c16-14-5-2-8-17(10-14)15(18)13-7-6-11-3-1-4-12(11)9-13/h6-7,9,14H,1-5,8,10,16H2.
What are the key properties of (3-aminopiperidin-1-yl)-(2,3-dihydro-1H-inden-5-yl)methanone?
(3-aminopiperidin-1-yl)-(2,3-dihydro-1H-inden-5-yl)methanone has a molecular weight of 244.34 g/mol, XLogP of 1.74, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-aminopiperidin-1-yl)-(2,3-dihydro-1H-inden-5-yl)methanone is sourced from PubChem (CID 61298118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).