2-N-(2,3-dihydro-1H-inden-5-yl)cyclobutane-1,2-dicarboxamide

C15H18N2O2 — CID 122134376

IUPAC2-N-(2,3-dihydro-1H-inden-5-yl)cyclobutane-1,2-dicarboxamide
SMILESNC(=O)C1CCC1C(=O)Nc1ccc2c(c1)CCC2
InChIInChI=1S/C15H18N2O2/c16-14(18)12-6-7-13(12)15(19)17-11-5-4-9-2-1-3-10(9)8-11/h4-5,8,12-13H,1-3,6-7H2,(H2,16,18)(H,17,19)
InChIKeyLBVZEUINJWLGBH-UHFFFAOYSA-N
MW258.32 g/mol
LogP1.63
Rot. Bonds3

About 2-N-(2,3-dihydro-1H-inden-5-yl)cyclobutane-1,2-dicarboxamide

2-N-(2,3-dihydro-1H-inden-5-yl)cyclobutane-1,2-dicarboxamide (PubChem CID 122134376) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is 2-N-(2,3-dihydro-1H-inden-5-yl)cyclobutane-1,2-dicarboxamide.

Molecular Properties

Compound Name2-N-(2,3-dihydro-1H-inden-5-yl)cyclobutane-1,2-dicarboxamide
PubChem CID122134376
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Name2-N-(2,3-dihydro-1H-inden-5-yl)cyclobutane-1,2-dicarboxamide
SMILESNC(=O)C1CCC1C(=O)Nc1ccc2c(c1)CCC2
InChIInChI=1S/C15H18N2O2/c16-14(18)12-6-7-13(12)15(19)17-11-5-4-9-2-1-3-10(9)8-11/h4-5,8,12-13H,1-3,6-7H2,(H2,16,18)(H,17,19)
InChIKeyLBVZEUINJWLGBH-UHFFFAOYSA-N
XLogP1.63
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-(2,3-dihydro-1H-inden-5-yl)cyclopentane-1-carboxamide
CID 64817762
3-amino-N-(5,6,7,8-tetrahydronaphthalen-2-yl)cyclobutane-1-carboxamide
CID 115161265
(3Z)-3-amino-N-(2,3-dihydro-1H-inden-5-yl)-3-hydroxyiminopropanamide
CID 43156060
(1S,2S,3S,4S)-3-(2,3-dihydro-1H-inden-5-ylcarbamoyl)bicyclo[2.2.1]heptane-2-carboxylic acid
CID 124553066
(1S,5R)-N-(2,3-dihydro-1H-inden-5-yl)-9-oxobicyclo[3.3.1]nonane-3-carboxamide
CID 8920716
2-N-[4-(2-oxopyrrolidin-1-yl)phenyl]cyclobutane-1,2-dicarboxamide
CID 167890277
2-[(1R,2S)-2-cyclopropylcyclopropyl]-1-(2,3-dihydro-1H-inden-5-yl)guanidine
CID 120666060
1-acetyl-N-(2,3-dihydro-1H-inden-5-yl)piperidine-4-carboxamide
CID 6468881
N-(2,3-dihydro-1H-inden-5-yl)-2-hydrazinyl-2-oxoacetamide
CID 43163947
N-(5,6,7,8-tetrahydronaphthalen-2-yl)pyrrolidine-3-carboxamide
CID 115159350
(2S,5R)-5-(aminomethyl)-N-(2,3-dihydro-1H-inden-5-yl)oxolane-2-carboxamide;hydrochloride
CID 120783405
1-cycloheptyl-3-(2,3-dihydro-1H-inden-5-yl)urea
CID 47132834

Frequently Asked Questions

What is the IUPAC name of 2-N-(2,3-dihydro-1H-inden-5-yl)cyclobutane-1,2-dicarboxamide?
The IUPAC name of 2-N-(2,3-dihydro-1H-inden-5-yl)cyclobutane-1,2-dicarboxamide (CID 122134376) is 2-N-(2,3-dihydro-1H-inden-5-yl)cyclobutane-1,2-dicarboxamide.
What is the SMILES notation for 2-N-(2,3-dihydro-1H-inden-5-yl)cyclobutane-1,2-dicarboxamide?
The canonical SMILES for 2-N-(2,3-dihydro-1H-inden-5-yl)cyclobutane-1,2-dicarboxamide is NC(=O)C1CCC1C(=O)Nc1ccc2c(c1)CCC2.
What is the InChIKey of 2-N-(2,3-dihydro-1H-inden-5-yl)cyclobutane-1,2-dicarboxamide?
The InChIKey is LBVZEUINJWLGBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c16-14(18)12-6-7-13(12)15(19)17-11-5-4-9-2-1-3-10(9)8-11/h4-5,8,12-13H,1-3,6-7H2,(H2,16,18)(H,17,19).
What are the key properties of 2-N-(2,3-dihydro-1H-inden-5-yl)cyclobutane-1,2-dicarboxamide?
2-N-(2,3-dihydro-1H-inden-5-yl)cyclobutane-1,2-dicarboxamide has a molecular weight of 258.32 g/mol, XLogP of 1.63, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(2,3-dihydro-1H-inden-5-yl)cyclobutane-1,2-dicarboxamide is sourced from PubChem (CID 122134376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).