N-[(3R)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]-2-(2,5-dimethoxyphenyl)acetamide

C24H30N2O3 — CID 25295085

IUPACN-[(3R)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]-2-(2,5-dimethoxyphenyl)acetamide
SMILESCOc1ccc(OC)c(CC(=O)N[C@@H]2CCCN(C3Cc4ccccc4C3)C2)c1
InChIInChI=1S/C24H30N2O3/c1-28-22-9-10-23(29-2)19(14-22)15-24(27)25-20-8-5-11-26(16-20)21-12-17-6-3-4-7-18(17)13-21/h3-4,6-7,9-10,14,20-21H,5,8,11-13,15-16H2,1-2H3,(H,25,27)/t20-/m1/s1
InChIKeyPZELYTSMHONUSS-HXUWFJFHSA-N
MW394.52 g/mol
LogP2.99
Rot. Bonds6

About N-[(3R)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]-2-(2,5-dimethoxyphenyl)acetamide

N-[(3R)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]-2-(2,5-dimethoxyphenyl)acetamide (PubChem CID 25295085) has the molecular formula C24H30N2O3 and a molecular weight of 394.52 g/mol. Its IUPAC name is N-[(3R)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]-2-(2,5-dimethoxyphenyl)acetamide.

Molecular Properties

Compound NameN-[(3R)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]-2-(2,5-dimethoxyphenyl)acetamide
PubChem CID25295085
Molecular FormulaC24H30N2O3
Molecular Weight394.52 g/mol
Exact Mass394.23
IUPAC NameN-[(3R)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]-2-(2,5-dimethoxyphenyl)acetamide
SMILESCOc1ccc(OC)c(CC(=O)N[C@@H]2CCCN(C3Cc4ccccc4C3)C2)c1
InChIInChI=1S/C24H30N2O3/c1-28-22-9-10-23(29-2)19(14-22)15-24(27)25-20-8-5-11-26(16-20)21-12-17-6-3-4-7-18(17)13-21/h3-4,6-7,9-10,14,20-21H,5,8,11-13,15-16H2,1-2H3,(H,25,27)/t20-/m1/s1
InChIKeyPZELYTSMHONUSS-HXUWFJFHSA-N
XLogP2.99
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.52
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cycloheptyl-2-(2,5-dimethoxyphenyl)acetamide
CID 7580886
N-[1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]-3-phenoxypropanamide
CID 45200396
2-(2,5-dimethoxyphenyl)-N-(1-pyridin-2-ylpiperidin-4-yl)acetamide
CID 78876192
N-(1-benzylpiperidin-3-yl)-2-(2,4-dimethoxyphenyl)acetamide
CID 55644626
2-(4-methoxyphenoxy)-N-[(3S)-1-(1-methylpiperidin-4-yl)piperidin-3-yl]acetamide
CID 28957064
N-(1-cycloheptylpiperidin-3-yl)-2-(2-methoxyphenoxy)acetamide
CID 45214844
2-(2,5-dimethoxyphenyl)-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]acetamide
CID 78901882
N-(4-aminocyclohexyl)-2-(2,5-dimethoxyphenyl)acetamide
CID 119476462
N-[1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]-3-(3,5-dimethylpyrazol-1-yl)propanamide
CID 45191724
N-cyclopropyl-2-[(2,5-dimethoxyphenyl)methylamino]acetamide
CID 43401917
N-cyclopentyl-2-(2,4-dimethoxyphenyl)acetamide
CID 17474203
N-[(3S)-1-cycloheptylpiperidin-3-yl]-3-(4-methoxyphenyl)propanamide
CID 42342863

Frequently Asked Questions

What is the IUPAC name of N-[(3R)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]-2-(2,5-dimethoxyphenyl)acetamide?
The IUPAC name of N-[(3R)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]-2-(2,5-dimethoxyphenyl)acetamide (CID 25295085) is N-[(3R)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]-2-(2,5-dimethoxyphenyl)acetamide.
What is the SMILES notation for N-[(3R)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]-2-(2,5-dimethoxyphenyl)acetamide?
The canonical SMILES for N-[(3R)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]-2-(2,5-dimethoxyphenyl)acetamide is COc1ccc(OC)c(CC(=O)N[C@@H]2CCCN(C3Cc4ccccc4C3)C2)c1.
What is the InChIKey of N-[(3R)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]-2-(2,5-dimethoxyphenyl)acetamide?
The InChIKey is PZELYTSMHONUSS-HXUWFJFHSA-N. The full InChI is InChI=1S/C24H30N2O3/c1-28-22-9-10-23(29-2)19(14-22)15-24(27)25-20-8-5-11-26(16-20)21-12-17-6-3-4-7-18(17)13-21/h3-4,6-7,9-10,14,20-21H,5,8,11-13,15-16H2,1-2H3,(H,25,27)/t20-/m1/s1.
What are the key properties of N-[(3R)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]-2-(2,5-dimethoxyphenyl)acetamide?
N-[(3R)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]-2-(2,5-dimethoxyphenyl)acetamide has a molecular weight of 394.52 g/mol, XLogP of 2.99, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3R)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]-2-(2,5-dimethoxyphenyl)acetamide is sourced from PubChem (CID 25295085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).