N-(2,3-dihydro-1H-inden-2-yl)-N-[(2-methoxyphenyl)methyl]-2-phenylbenzamide

C30H27NO2 — CID 69326258

IUPACN-(2,3-dihydro-1H-inden-2-yl)-N-[(2-methoxyphenyl)methyl]-2-phenylbenzamide
SMILESCOc1ccccc1CN(C(=O)c1ccccc1-c1ccccc1)C1Cc2ccccc2C1
InChIInChI=1S/C30H27NO2/c1-33-29-18-10-7-15-25(29)21-31(26-19-23-13-5-6-14-24(23)20-26)30(32)28-17-9-8-16-27(28)22-11-3-2-4-12-22/h2-18,26H,19-21H2,1H3
InChIKeyNZSQXXGWHLPSOQ-UHFFFAOYSA-N
MW433.55 g/mol
LogP6.17
Rot. Bonds6

About N-(2,3-dihydro-1H-inden-2-yl)-N-[(2-methoxyphenyl)methyl]-2-phenylbenzamide

N-(2,3-dihydro-1H-inden-2-yl)-N-[(2-methoxyphenyl)methyl]-2-phenylbenzamide (PubChem CID 69326258) has the molecular formula C30H27NO2 and a molecular weight of 433.55 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-inden-2-yl)-N-[(2-methoxyphenyl)methyl]-2-phenylbenzamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-inden-2-yl)-N-[(2-methoxyphenyl)methyl]-2-phenylbenzamide
PubChem CID69326258
Molecular FormulaC30H27NO2
Molecular Weight433.55 g/mol
Exact Mass433.20
IUPAC NameN-(2,3-dihydro-1H-inden-2-yl)-N-[(2-methoxyphenyl)methyl]-2-phenylbenzamide
SMILESCOc1ccccc1CN(C(=O)c1ccccc1-c1ccccc1)C1Cc2ccccc2C1
InChIInChI=1S/C30H27NO2/c1-33-29-18-10-7-15-25(29)21-31(26-19-23-13-5-6-14-24(23)20-26)30(32)28-17-9-8-16-27(28)22-11-3-2-4-12-22/h2-18,26H,19-21H2,1H3
InChIKeyNZSQXXGWHLPSOQ-UHFFFAOYSA-N
XLogP6.17
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500433.55
LogP ≤ 56.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,3-dihydro-1H-inden-2-yl)-N-[(2-methoxyphenyl)methyl]-2-thiophen-3-ylbenzamide
CID 10194938
N-(2,3-dihydro-1H-inden-2-yl)-N-[(3-methoxyphenyl)methyl]-2-phenylbenzamide
CID 91173289
N-(2,3-dihydro-1H-inden-2-yl)-2-(4-methylphenyl)-N-[(4-methylphenyl)methyl]benzamide
CID 10127237
N-cyclopropyl-N-[(2-methoxyphenyl)methyl]-2-methylsulfanylpyridine-3-carboxamide
CID 46986860
N-(2,3-dihydro-1H-inden-2-yl)-N-[(4-methoxyphenyl)methyl]-2-methyl-6-phenylbenzamide
CID 22566943
2-[4-[cyclopropyl-[(2-methoxyphenyl)methyl]carbamoyl]-2-ethoxyphenoxy]acetic acid
CID 119180543
N-[(2-methoxyphenyl)methyl]-N-[(2-phenylphenyl)methyl]-2-pyrrol-1-ylbenzamide
CID 10310864
ethyl N-cyclopropyl-N-[(2-methoxyphenyl)methyl]carbamate
CID 61068925
4-(aminomethyl)-N-cyclopropyl-N-[(2-methoxyphenyl)methyl]benzamide;hydrochloride
CID 119284935
(2R)-2-amino-N-cyclopropyl-N-[(2-methoxyphenyl)methyl]propanamide
CID 54995705
(2S)-3-[cyclopropyl-(2-methoxybenzoyl)amino]-2-methylpropanoic acid
CID 95540234
N-cyclopropyl-3-ethoxy-4-methoxy-N-[(2-methoxyphenyl)methyl]benzamide
CID 87027506

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-inden-2-yl)-N-[(2-methoxyphenyl)methyl]-2-phenylbenzamide?
The IUPAC name of N-(2,3-dihydro-1H-inden-2-yl)-N-[(2-methoxyphenyl)methyl]-2-phenylbenzamide (CID 69326258) is N-(2,3-dihydro-1H-inden-2-yl)-N-[(2-methoxyphenyl)methyl]-2-phenylbenzamide.
What is the SMILES notation for N-(2,3-dihydro-1H-inden-2-yl)-N-[(2-methoxyphenyl)methyl]-2-phenylbenzamide?
The canonical SMILES for N-(2,3-dihydro-1H-inden-2-yl)-N-[(2-methoxyphenyl)methyl]-2-phenylbenzamide is COc1ccccc1CN(C(=O)c1ccccc1-c1ccccc1)C1Cc2ccccc2C1.
What is the InChIKey of N-(2,3-dihydro-1H-inden-2-yl)-N-[(2-methoxyphenyl)methyl]-2-phenylbenzamide?
The InChIKey is NZSQXXGWHLPSOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H27NO2/c1-33-29-18-10-7-15-25(29)21-31(26-19-23-13-5-6-14-24(23)20-26)30(32)28-17-9-8-16-27(28)22-11-3-2-4-12-22/h2-18,26H,19-21H2,1H3.
What are the key properties of N-(2,3-dihydro-1H-inden-2-yl)-N-[(2-methoxyphenyl)methyl]-2-phenylbenzamide?
N-(2,3-dihydro-1H-inden-2-yl)-N-[(2-methoxyphenyl)methyl]-2-phenylbenzamide has a molecular weight of 433.55 g/mol, XLogP of 6.17, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-inden-2-yl)-N-[(2-methoxyphenyl)methyl]-2-phenylbenzamide is sourced from PubChem (CID 69326258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).