(2R)-2-acetamido-N-(4-cyanophenyl)-2-cyclopentylacetamide

C16H19N3O2 — CID 25469679

IUPAC(2R)-2-acetamido-N-(4-cyanophenyl)-2-cyclopentylacetamide
SMILESCC(=O)N[C@@H](C(=O)Nc1ccc(C#N)cc1)C1CCCC1
InChIInChI=1S/C16H19N3O2/c1-11(20)18-15(13-4-2-3-5-13)16(21)19-14-8-6-12(10-17)7-9-14/h6-9,13,15H,2-5H2,1H3,(H,18,20)(H,19,21)/t15-/m1/s1
InChIKeyLLCLSRRRBDQJNS-OAHLLOKOSA-N
MW285.35 g/mol
LogP2.19
Rot. Bonds4

About (2R)-2-acetamido-N-(4-cyanophenyl)-2-cyclopentylacetamide

(2R)-2-acetamido-N-(4-cyanophenyl)-2-cyclopentylacetamide (PubChem CID 25469679) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is (2R)-2-acetamido-N-(4-cyanophenyl)-2-cyclopentylacetamide.

Molecular Properties

Compound Name(2R)-2-acetamido-N-(4-cyanophenyl)-2-cyclopentylacetamide
PubChem CID25469679
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name(2R)-2-acetamido-N-(4-cyanophenyl)-2-cyclopentylacetamide
SMILESCC(=O)N[C@@H](C(=O)Nc1ccc(C#N)cc1)C1CCCC1
InChIInChI=1S/C16H19N3O2/c1-11(20)18-15(13-4-2-3-5-13)16(21)19-14-8-6-12(10-17)7-9-14/h6-9,13,15H,2-5H2,1H3,(H,18,20)(H,19,21)/t15-/m1/s1
InChIKeyLLCLSRRRBDQJNS-OAHLLOKOSA-N
XLogP2.19
TPSA81.99 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-acetamido-2-cyclopentyl-N-(4-methylsulfonylphenyl)acetamide
CID 51272392
2-acetamido-2-cyclopentyl-N-(2,3-dihydro-1H-inden-5-yl)acetamide
CID 17448058
2-acetamido-2-cyclopentyl-N-(4-morpholin-4-ylphenyl)acetamide
CID 42924063
2-[(4-cyanophenyl)carbamoylamino]-2-cyclopropylacetic acid
CID 62695579
2-acetamido-2-cyclopentyl-N-[4-[(4-methylpiperidin-1-yl)methyl]phenyl]acetamide
CID 55972376
N-(4-cyanophenyl)-2-sulfanylpropanamide
CID 107021186
N-(4-cyanophenyl)-2-(2-methylpiperidin-1-yl)propanamide
CID 43176778
N-(4-cyanophenyl)-2-propan-2-yloxypropanamide
CID 43824380
2-acetamido-2-cyclopentyl-N-(3-ethylphenyl)acetamide
CID 51272125
2-acetamido-2-cyclopentyl-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]acetamide
CID 51123302
(2R)-2-acetamido-2-cyclopentyl-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]acetamide
CID 52511671
2-acetamido-N-(3-amino-4-methoxyphenyl)-2-cyclopentylacetamide;hydrochloride
CID 119419106

Frequently Asked Questions

What is the IUPAC name of (2R)-2-acetamido-N-(4-cyanophenyl)-2-cyclopentylacetamide?
The IUPAC name of (2R)-2-acetamido-N-(4-cyanophenyl)-2-cyclopentylacetamide (CID 25469679) is (2R)-2-acetamido-N-(4-cyanophenyl)-2-cyclopentylacetamide.
What is the SMILES notation for (2R)-2-acetamido-N-(4-cyanophenyl)-2-cyclopentylacetamide?
The canonical SMILES for (2R)-2-acetamido-N-(4-cyanophenyl)-2-cyclopentylacetamide is CC(=O)N[C@@H](C(=O)Nc1ccc(C#N)cc1)C1CCCC1.
What is the InChIKey of (2R)-2-acetamido-N-(4-cyanophenyl)-2-cyclopentylacetamide?
The InChIKey is LLCLSRRRBDQJNS-OAHLLOKOSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-11(20)18-15(13-4-2-3-5-13)16(21)19-14-8-6-12(10-17)7-9-14/h6-9,13,15H,2-5H2,1H3,(H,18,20)(H,19,21)/t15-/m1/s1.
What are the key properties of (2R)-2-acetamido-N-(4-cyanophenyl)-2-cyclopentylacetamide?
(2R)-2-acetamido-N-(4-cyanophenyl)-2-cyclopentylacetamide has a molecular weight of 285.35 g/mol, XLogP of 2.19, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-acetamido-N-(4-cyanophenyl)-2-cyclopentylacetamide is sourced from PubChem (CID 25469679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).