N-(2-methylprop-2-enyl)-2,3-dihydro-1H-indene-5-carboxamide

C14H17NO — CID 114618954

IUPACN-(2-methylprop-2-enyl)-2,3-dihydro-1H-indene-5-carboxamide
SMILESC=C(C)CNC(=O)c1ccc2c(c1)CCC2
InChIInChI=1S/C14H17NO/c1-10(2)9-15-14(16)13-7-6-11-4-3-5-12(11)8-13/h6-8H,1,3-5,9H2,2H3,(H,15,16)
InChIKeySTJIASTVTCKJLP-UHFFFAOYSA-N
MW215.30 g/mol
LogP2.48
Rot. Bonds3

About N-(2-methylprop-2-enyl)-2,3-dihydro-1H-indene-5-carboxamide

N-(2-methylprop-2-enyl)-2,3-dihydro-1H-indene-5-carboxamide (PubChem CID 114618954) has the molecular formula C14H17NO and a molecular weight of 215.30 g/mol. Its IUPAC name is N-(2-methylprop-2-enyl)-2,3-dihydro-1H-indene-5-carboxamide.

Molecular Properties

Compound NameN-(2-methylprop-2-enyl)-2,3-dihydro-1H-indene-5-carboxamide
PubChem CID114618954
Molecular FormulaC14H17NO
Molecular Weight215.30 g/mol
Exact Mass215.13
IUPAC NameN-(2-methylprop-2-enyl)-2,3-dihydro-1H-indene-5-carboxamide
SMILESC=C(C)CNC(=O)c1ccc2c(c1)CCC2
InChIInChI=1S/C14H17NO/c1-10(2)9-15-14(16)13-7-6-11-4-3-5-12(11)8-13/h6-8H,1,3-5,9H2,2H3,(H,15,16)
InChIKeySTJIASTVTCKJLP-UHFFFAOYSA-N
XLogP2.48
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-(2-amino-2-oxoethyl)-2,3-dihydro-1H-indene-5-carboxamide
CID 9295424
N-[2-oxo-2-(propan-2-ylamino)ethyl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 9300971
N-(2-methylprop-2-enyl)-2,3-dihydro-1-benzofuran-5-carboxamide
CID 114618555
N-[2-(2,3-dihydro-1H-inden-5-yl)-2-oxoethyl]acetamide
CID 82113869
3-(2,3-dihydro-1H-indene-5-carbonylamino)propanoic acid
CID 18071901
3-amino-4-methyl-N-(2-methylprop-2-enyl)benzamide
CID 114614951
3-(2,3-dihydro-1H-indene-5-carbonylamino)-2-methylpropanoic acid
CID 55105106
1-(2,3-dihydro-1H-indene-5-carbonyl)-4-hydroxy-N-(2-methylprop-2-enyl)pyrrolidine-2-carboxamide
CID 166303347
N-[2-(2-hydroxyethoxy)ethyl]-2,3-dihydro-1H-indene-5-carboxamide
CID 55024103
N-(2-methylsulfonylethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 60545524
(2S)-3-(2,3-dihydro-1H-indene-5-carbonylamino)-2-hydroxypropanoic acid
CID 107833491
N-(4-hydroxy-2,2-dimethylbutyl)-2,3-dihydro-1H-indene-5-carboxamide
CID 103824963

Frequently Asked Questions

What is the IUPAC name of N-(2-methylprop-2-enyl)-2,3-dihydro-1H-indene-5-carboxamide?
The IUPAC name of N-(2-methylprop-2-enyl)-2,3-dihydro-1H-indene-5-carboxamide (CID 114618954) is N-(2-methylprop-2-enyl)-2,3-dihydro-1H-indene-5-carboxamide.
What is the SMILES notation for N-(2-methylprop-2-enyl)-2,3-dihydro-1H-indene-5-carboxamide?
The canonical SMILES for N-(2-methylprop-2-enyl)-2,3-dihydro-1H-indene-5-carboxamide is C=C(C)CNC(=O)c1ccc2c(c1)CCC2.
What is the InChIKey of N-(2-methylprop-2-enyl)-2,3-dihydro-1H-indene-5-carboxamide?
The InChIKey is STJIASTVTCKJLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO/c1-10(2)9-15-14(16)13-7-6-11-4-3-5-12(11)8-13/h6-8H,1,3-5,9H2,2H3,(H,15,16).
What are the key properties of N-(2-methylprop-2-enyl)-2,3-dihydro-1H-indene-5-carboxamide?
N-(2-methylprop-2-enyl)-2,3-dihydro-1H-indene-5-carboxamide has a molecular weight of 215.30 g/mol, XLogP of 2.48, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylprop-2-enyl)-2,3-dihydro-1H-indene-5-carboxamide is sourced from PubChem (CID 114618954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).