N-benzyl-N-(6-methoxy-3H-inden-1-yl)propanamide

C20H21NO2 — CID 54527664

IUPACN-benzyl-N-(6-methoxy-3H-inden-1-yl)propanamide
SMILESCCC(=O)N(Cc1ccccc1)C1=CCc2ccc(OC)cc21
InChIInChI=1S/C20H21NO2/c1-3-20(22)21(14-15-7-5-4-6-8-15)19-12-10-16-9-11-17(23-2)13-18(16)19/h4-9,11-13H,3,10,14H2,1-2H3
InChIKeyYUGFMCBEIIVZEV-UHFFFAOYSA-N
MW307.39 g/mol
LogP4.03
Rot. Bonds5

About N-benzyl-N-(6-methoxy-3H-inden-1-yl)propanamide

N-benzyl-N-(6-methoxy-3H-inden-1-yl)propanamide (PubChem CID 54527664) has the molecular formula C20H21NO2 and a molecular weight of 307.39 g/mol. Its IUPAC name is N-benzyl-N-(6-methoxy-3H-inden-1-yl)propanamide.

Molecular Properties

Compound NameN-benzyl-N-(6-methoxy-3H-inden-1-yl)propanamide
PubChem CID54527664
Molecular FormulaC20H21NO2
Molecular Weight307.39 g/mol
Exact Mass307.16
IUPAC NameN-benzyl-N-(6-methoxy-3H-inden-1-yl)propanamide
SMILESCCC(=O)N(Cc1ccccc1)C1=CCc2ccc(OC)cc21
InChIInChI=1S/C20H21NO2/c1-3-20(22)21(14-15-7-5-4-6-8-15)19-12-10-16-9-11-17(23-2)13-18(16)19/h4-9,11-13H,3,10,14H2,1-2H3
InChIKeyYUGFMCBEIIVZEV-UHFFFAOYSA-N
XLogP4.03
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.39
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 3369631
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CID 52893645
N-benzyl-N-[4-[2-(4-methoxyanilino)-2-oxoethyl]phenyl]propanamide
CID 46045773
N-benzyl-N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]cyclopropanecarboxamide
CID 1138529
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1-N,3-N-dibenzyl-1-N,3-N-bis(4-methoxyphenyl)benzene-1,3-dicarboxamide
CID 10144171
N-benzyl-N-(4-methoxyphenyl)hexanamide
CID 60594646
N-benzyl-N-(4-methoxyphenyl)-2-pyrrolidin-2-ylacetamide
CID 119691210
N-benzyl-N-(6-methoxy-1,3-benzothiazol-2-yl)butanamide
CID 7615805
methyl 5-methoxy-3-[(4-methoxyphenyl)methyl-propanoylamino]pyridine-2-carboxylate
CID 167037611
N-benzyl-N-(2-bromo-4-methoxyphenyl)-2-methylprop-2-enamide
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N-benzyl-2-(2,4-dimethoxyphenyl)-N-methylacetamide
CID 110767880

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-(6-methoxy-3H-inden-1-yl)propanamide?
The IUPAC name of N-benzyl-N-(6-methoxy-3H-inden-1-yl)propanamide (CID 54527664) is N-benzyl-N-(6-methoxy-3H-inden-1-yl)propanamide.
What is the SMILES notation for N-benzyl-N-(6-methoxy-3H-inden-1-yl)propanamide?
The canonical SMILES for N-benzyl-N-(6-methoxy-3H-inden-1-yl)propanamide is CCC(=O)N(Cc1ccccc1)C1=CCc2ccc(OC)cc21.
What is the InChIKey of N-benzyl-N-(6-methoxy-3H-inden-1-yl)propanamide?
The InChIKey is YUGFMCBEIIVZEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21NO2/c1-3-20(22)21(14-15-7-5-4-6-8-15)19-12-10-16-9-11-17(23-2)13-18(16)19/h4-9,11-13H,3,10,14H2,1-2H3.
What are the key properties of N-benzyl-N-(6-methoxy-3H-inden-1-yl)propanamide?
N-benzyl-N-(6-methoxy-3H-inden-1-yl)propanamide has a molecular weight of 307.39 g/mol, XLogP of 4.03, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-(6-methoxy-3H-inden-1-yl)propanamide is sourced from PubChem (CID 54527664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).