2-[3-[methyl(pyridin-3-ylmethyl)amino]cyclopentyl]-2,2-diphenylacetamide

C26H29N3O — CID 70303251

IUPAC2-[3-[methyl(pyridin-3-ylmethyl)amino]cyclopentyl]-2,2-diphenylacetamide
SMILESCN(Cc1cccnc1)C1CCC(C(C(N)=O)(c2ccccc2)c2ccccc2)C1
InChIInChI=1S/C26H29N3O/c1-29(19-20-9-8-16-28-18-20)24-15-14-23(17-24)26(25(27)30,21-10-4-2-5-11-21)22-12-6-3-7-13-22/h2-13,16,18,23-24H,14-15,17,19H2,1H3,(H2,27,30)
InChIKeyINZDEPSGWMWUSE-UHFFFAOYSA-N
MW399.54 g/mol
LogP4.15
Rot. Bonds7

About 2-[3-[methyl(pyridin-3-ylmethyl)amino]cyclopentyl]-2,2-diphenylacetamide

2-[3-[methyl(pyridin-3-ylmethyl)amino]cyclopentyl]-2,2-diphenylacetamide (PubChem CID 70303251) has the molecular formula C26H29N3O and a molecular weight of 399.54 g/mol. Its IUPAC name is 2-[3-[methyl(pyridin-3-ylmethyl)amino]cyclopentyl]-2,2-diphenylacetamide.

Molecular Properties

Compound Name2-[3-[methyl(pyridin-3-ylmethyl)amino]cyclopentyl]-2,2-diphenylacetamide
PubChem CID70303251
Molecular FormulaC26H29N3O
Molecular Weight399.54 g/mol
Exact Mass399.23
IUPAC Name2-[3-[methyl(pyridin-3-ylmethyl)amino]cyclopentyl]-2,2-diphenylacetamide
SMILESCN(Cc1cccnc1)C1CCC(C(C(N)=O)(c2ccccc2)c2ccccc2)C1
InChIInChI=1S/C26H29N3O/c1-29(19-20-9-8-16-28-18-20)24-15-14-23(17-24)26(25(27)30,21-10-4-2-5-11-21)22-12-6-3-7-13-22/h2-13,16,18,23-24H,14-15,17,19H2,1H3,(H2,27,30)
InChIKeyINZDEPSGWMWUSE-UHFFFAOYSA-N
XLogP4.15
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.54
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[3-[methyl(pyridin-4-ylmethyl)amino]cyclopentyl]-2,2-diphenylacetamide
CID 70303045
2-[3-[methyl-[2-(4-nitrophenyl)ethyl]amino]cyclopentyl]-2,2-diphenylacetamide
CID 70302941
trans-(1R,3R)-N-methyl-3-methylsulfanyl-N-(pyridin-3-ylmethyl)cyclopentan-1-amine
CID 99106803
N,4-dimethyl-N-(pyridin-3-ylmethyl)cyclohexan-1-amine;ethane;methane
CID 161242864
4-[methyl(pyridin-3-ylmethyl)amino]-1-propylsulfonylpiperidine-2-carboxylic acid
CID 134073770
2,2-diphenyl-2-[3-(4-phenylbutylamino)cyclopentyl]acetamide
CID 70304083
4-[methyl(pyridin-3-ylmethyl)amino]cyclohexane-1-carbonitrile
CID 115150222
(2R,4R)-1-[(5-methylfuran-2-yl)methyl]-4-[methyl(pyridin-3-ylmethyl)amino]piperidine-2-carboxylic acid
CID 97415912
2-cyclopropyl-N-phenyl-N-(pyridin-3-ylmethyl)propanamide
CID 110613046
4-[cyclopropyl(pyridin-3-ylmethyl)amino]-2,3-dimethyl-4-oxobutanoic acid
CID 103497568
tert-butyl (3R)-3-[methyl(pyridin-3-ylmethyl)amino]pyrrolidine-1-carboxylate
CID 71647429
4-[methyl(pyridin-3-ylmethyl)amino]-1-(thiophene-3-carbonyl)piperidine-2-carboxylic acid
CID 131657853

Frequently Asked Questions

What is the IUPAC name of 2-[3-[methyl(pyridin-3-ylmethyl)amino]cyclopentyl]-2,2-diphenylacetamide?
The IUPAC name of 2-[3-[methyl(pyridin-3-ylmethyl)amino]cyclopentyl]-2,2-diphenylacetamide (CID 70303251) is 2-[3-[methyl(pyridin-3-ylmethyl)amino]cyclopentyl]-2,2-diphenylacetamide.
What is the SMILES notation for 2-[3-[methyl(pyridin-3-ylmethyl)amino]cyclopentyl]-2,2-diphenylacetamide?
The canonical SMILES for 2-[3-[methyl(pyridin-3-ylmethyl)amino]cyclopentyl]-2,2-diphenylacetamide is CN(Cc1cccnc1)C1CCC(C(C(N)=O)(c2ccccc2)c2ccccc2)C1.
What is the InChIKey of 2-[3-[methyl(pyridin-3-ylmethyl)amino]cyclopentyl]-2,2-diphenylacetamide?
The InChIKey is INZDEPSGWMWUSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H29N3O/c1-29(19-20-9-8-16-28-18-20)24-15-14-23(17-24)26(25(27)30,21-10-4-2-5-11-21)22-12-6-3-7-13-22/h2-13,16,18,23-24H,14-15,17,19H2,1H3,(H2,27,30).
What are the key properties of 2-[3-[methyl(pyridin-3-ylmethyl)amino]cyclopentyl]-2,2-diphenylacetamide?
2-[3-[methyl(pyridin-3-ylmethyl)amino]cyclopentyl]-2,2-diphenylacetamide has a molecular weight of 399.54 g/mol, XLogP of 4.15, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[methyl(pyridin-3-ylmethyl)amino]cyclopentyl]-2,2-diphenylacetamide is sourced from PubChem (CID 70303251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).