N-(2,6-dichlorophenyl)-2,3-dihydro-1H-indene-2-carboxamide

C16H13Cl2NO — CID 112525347

IUPACN-(2,6-dichlorophenyl)-2,3-dihydro-1H-indene-2-carboxamide
SMILESO=C(Nc1c(Cl)cccc1Cl)C1Cc2ccccc2C1
InChIInChI=1S/C16H13Cl2NO/c17-13-6-3-7-14(18)15(13)19-16(20)12-8-10-4-1-2-5-11(10)9-12/h1-7,12H,8-9H2,(H,19,20)
InChIKeyRSUKRFOSWZQGCL-UHFFFAOYSA-N
MW306.19 g/mol
LogP4.35
Rot. Bonds2

About N-(2,6-dichlorophenyl)-2,3-dihydro-1H-indene-2-carboxamide

N-(2,6-dichlorophenyl)-2,3-dihydro-1H-indene-2-carboxamide (PubChem CID 112525347) has the molecular formula C16H13Cl2NO and a molecular weight of 306.19 g/mol. Its IUPAC name is N-(2,6-dichlorophenyl)-2,3-dihydro-1H-indene-2-carboxamide.

Molecular Properties

Compound NameN-(2,6-dichlorophenyl)-2,3-dihydro-1H-indene-2-carboxamide
PubChem CID112525347
Molecular FormulaC16H13Cl2NO
Molecular Weight306.19 g/mol
Exact Mass305.04
IUPAC NameN-(2,6-dichlorophenyl)-2,3-dihydro-1H-indene-2-carboxamide
SMILESO=C(Nc1c(Cl)cccc1Cl)C1Cc2ccccc2C1
InChIInChI=1S/C16H13Cl2NO/c17-13-6-3-7-14(18)15(13)19-16(20)12-8-10-4-1-2-5-11(10)9-12/h1-7,12H,8-9H2,(H,19,20)
InChIKeyRSUKRFOSWZQGCL-UHFFFAOYSA-N
XLogP4.35
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.19
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(2,6-dichlorophenyl)-2,3-dihydro-1H-indene-2-carboxamide?
The IUPAC name of N-(2,6-dichlorophenyl)-2,3-dihydro-1H-indene-2-carboxamide (CID 112525347) is N-(2,6-dichlorophenyl)-2,3-dihydro-1H-indene-2-carboxamide.
What is the SMILES notation for N-(2,6-dichlorophenyl)-2,3-dihydro-1H-indene-2-carboxamide?
The canonical SMILES for N-(2,6-dichlorophenyl)-2,3-dihydro-1H-indene-2-carboxamide is O=C(Nc1c(Cl)cccc1Cl)C1Cc2ccccc2C1.
What is the InChIKey of N-(2,6-dichlorophenyl)-2,3-dihydro-1H-indene-2-carboxamide?
The InChIKey is RSUKRFOSWZQGCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13Cl2NO/c17-13-6-3-7-14(18)15(13)19-16(20)12-8-10-4-1-2-5-11(10)9-12/h1-7,12H,8-9H2,(H,19,20).
What are the key properties of N-(2,6-dichlorophenyl)-2,3-dihydro-1H-indene-2-carboxamide?
N-(2,6-dichlorophenyl)-2,3-dihydro-1H-indene-2-carboxamide has a molecular weight of 306.19 g/mol, XLogP of 4.35, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dichlorophenyl)-2,3-dihydro-1H-indene-2-carboxamide is sourced from PubChem (CID 112525347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).