2-[2-[cyclopentyl(methyl)amino]anilino]-N-methyl-N-phenylacetamide

C21H27N3O — CID 71849650

IUPAC2-[2-[cyclopentyl(methyl)amino]anilino]-N-methyl-N-phenylacetamide
SMILESCN(C(=O)CNc1ccccc1N(C)C1CCCC1)c1ccccc1
InChIInChI=1S/C21H27N3O/c1-23(17-12-6-7-13-17)20-15-9-8-14-19(20)22-16-21(25)24(2)18-10-4-3-5-11-18/h3-5,8-11,14-15,17,22H,6-7,12-13,16H2,1-2H3
InChIKeyRBGWNZXFIYWMSA-UHFFFAOYSA-N
MW337.47 g/mol
LogP4.14
Rot. Bonds6

About 2-[2-[cyclopentyl(methyl)amino]anilino]-N-methyl-N-phenylacetamide

2-[2-[cyclopentyl(methyl)amino]anilino]-N-methyl-N-phenylacetamide (PubChem CID 71849650) has the molecular formula C21H27N3O and a molecular weight of 337.47 g/mol. Its IUPAC name is 2-[2-[cyclopentyl(methyl)amino]anilino]-N-methyl-N-phenylacetamide.

Molecular Properties

Compound Name2-[2-[cyclopentyl(methyl)amino]anilino]-N-methyl-N-phenylacetamide
PubChem CID71849650
Molecular FormulaC21H27N3O
Molecular Weight337.47 g/mol
Exact Mass337.22
IUPAC Name2-[2-[cyclopentyl(methyl)amino]anilino]-N-methyl-N-phenylacetamide
SMILESCN(C(=O)CNc1ccccc1N(C)C1CCCC1)c1ccccc1
InChIInChI=1S/C21H27N3O/c1-23(17-12-6-7-13-17)20-15-9-8-14-19(20)22-16-21(25)24(2)18-10-4-3-5-11-18/h3-5,8-11,14-15,17,22H,6-7,12-13,16H2,1-2H3
InChIKeyRBGWNZXFIYWMSA-UHFFFAOYSA-N
XLogP4.14
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.47
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(benzylcarbamoyl)-2-[2-[cyclopentyl(methyl)amino]anilino]acetamide
CID 71849649
2-[cyclopentyl-[2-(N-methylanilino)-2-oxoethyl]amino]acetic acid
CID 60833811
N-methyl-N-phenyl-2-(2-phenylsulfanylanilino)acetamide
CID 24583235
N-[2-[cyclopentyl(methyl)amino]phenyl]-2-(cyclopropylmethylamino)acetamide
CID 119899295
N-methyl-2-[2-(oxolan-2-ylmethoxy)anilino]-N-phenylacetamide
CID 54829826
N-methyl-N-phenyl-2-[2-(2-phenylethynyl)anilino]acetamide
CID 132939036
N-[2-[cyclopentyl(methyl)amino]phenyl]-2-hydroxycyclopentane-1-carboxamide
CID 110015008
N-cyclohexyl-N-methyl-2-(2-propan-2-ylanilino)acetamide
CID 54823199
2-(cyclopropylmethylamino)-N-methyl-N-phenylacetamide
CID 60842442
2-amino-N-[2-[cyclopentyl(methyl)amino]phenyl]propanamide;dihydrochloride
CID 119899288
3-[cyclopentyl(methylsulfonyl)amino]-N-methyl-N-phenylpropanamide
CID 113137275
4-amino-N-[2-[cyclopentyl(methyl)amino]phenyl]butanamide
CID 119899319

Frequently Asked Questions

What is the IUPAC name of 2-[2-[cyclopentyl(methyl)amino]anilino]-N-methyl-N-phenylacetamide?
The IUPAC name of 2-[2-[cyclopentyl(methyl)amino]anilino]-N-methyl-N-phenylacetamide (CID 71849650) is 2-[2-[cyclopentyl(methyl)amino]anilino]-N-methyl-N-phenylacetamide.
What is the SMILES notation for 2-[2-[cyclopentyl(methyl)amino]anilino]-N-methyl-N-phenylacetamide?
The canonical SMILES for 2-[2-[cyclopentyl(methyl)amino]anilino]-N-methyl-N-phenylacetamide is CN(C(=O)CNc1ccccc1N(C)C1CCCC1)c1ccccc1.
What is the InChIKey of 2-[2-[cyclopentyl(methyl)amino]anilino]-N-methyl-N-phenylacetamide?
The InChIKey is RBGWNZXFIYWMSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27N3O/c1-23(17-12-6-7-13-17)20-15-9-8-14-19(20)22-16-21(25)24(2)18-10-4-3-5-11-18/h3-5,8-11,14-15,17,22H,6-7,12-13,16H2,1-2H3.
What are the key properties of 2-[2-[cyclopentyl(methyl)amino]anilino]-N-methyl-N-phenylacetamide?
2-[2-[cyclopentyl(methyl)amino]anilino]-N-methyl-N-phenylacetamide has a molecular weight of 337.47 g/mol, XLogP of 4.14, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[cyclopentyl(methyl)amino]anilino]-N-methyl-N-phenylacetamide is sourced from PubChem (CID 71849650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).