2-acetamido-2-cyclopentyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide

C20H29N3O2 — CID 55981326

IUPAC2-acetamido-2-cyclopentyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide
SMILESCC(=O)NC(C(=O)NCc1ccccc1N1CCCC1)C1CCCC1
InChIInChI=1S/C20H29N3O2/c1-15(24)22-19(16-8-2-3-9-16)20(25)21-14-17-10-4-5-11-18(17)23-12-6-7-13-23/h4-5,10-11,16,19H,2-3,6-9,12-14H2,1H3,(H,21,25)(H,22,24)
InChIKeyJYBDORFDKBDQIM-UHFFFAOYSA-N
MW343.47 g/mol
LogP2.60
Rot. Bonds6

About 2-acetamido-2-cyclopentyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide

2-acetamido-2-cyclopentyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide (PubChem CID 55981326) has the molecular formula C20H29N3O2 and a molecular weight of 343.47 g/mol. Its IUPAC name is 2-acetamido-2-cyclopentyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-acetamido-2-cyclopentyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide
PubChem CID55981326
Molecular FormulaC20H29N3O2
Molecular Weight343.47 g/mol
Exact Mass343.23
IUPAC Name2-acetamido-2-cyclopentyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide
SMILESCC(=O)NC(C(=O)NCc1ccccc1N1CCCC1)C1CCCC1
InChIInChI=1S/C20H29N3O2/c1-15(24)22-19(16-8-2-3-9-16)20(25)21-14-17-10-4-5-11-18(17)23-12-6-7-13-23/h4-5,10-11,16,19H,2-3,6-9,12-14H2,1H3,(H,21,25)(H,22,24)
InChIKeyJYBDORFDKBDQIM-UHFFFAOYSA-N
XLogP2.60
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.47
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-acetamido-2-cyclopentyl-N-[(2-fluorophenyl)methyl]acetamide
CID 27147840
2-acetamido-2-cyclopentyl-N-(2-phenylethyl)acetamide
CID 51271986
2-acetamido-N-(1,3-benzodioxol-5-ylmethyl)-2-cyclopentylacetamide
CID 51271886
1-cyclohexyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]ethanamine
CID 62405544
(2R)-2-methoxy-2-phenyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide
CID 94866137
1-(2-cyclopropyl-2-hydroxyethyl)-1-methyl-3-[(2-piperidin-1-ylphenyl)methyl]urea
CID 110013047
2-acetamido-N-(2-chlorophenyl)-2-cyclopentylacetamide
CID 42885299
2-acetamido-2-cyclopentyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]acetamide
CID 134026215
2-acetamido-2-cyclopentyl-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]acetamide
CID 51123302
2-acetamido-2-cyclopentyl-N-(2-methylphenyl)acetamide
CID 47126825
2-methyl-N-[(2-morpholin-4-ylphenyl)methyl]propanamide
CID 47400471
N-[[2-(4-aminopiperidin-1-yl)phenyl]methyl]propanamide
CID 91462308

Frequently Asked Questions

What is the IUPAC name of 2-acetamido-2-cyclopentyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide?
The IUPAC name of 2-acetamido-2-cyclopentyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide (CID 55981326) is 2-acetamido-2-cyclopentyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide.
What is the SMILES notation for 2-acetamido-2-cyclopentyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide?
The canonical SMILES for 2-acetamido-2-cyclopentyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide is CC(=O)NC(C(=O)NCc1ccccc1N1CCCC1)C1CCCC1.
What is the InChIKey of 2-acetamido-2-cyclopentyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide?
The InChIKey is JYBDORFDKBDQIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29N3O2/c1-15(24)22-19(16-8-2-3-9-16)20(25)21-14-17-10-4-5-11-18(17)23-12-6-7-13-23/h4-5,10-11,16,19H,2-3,6-9,12-14H2,1H3,(H,21,25)(H,22,24).
What are the key properties of 2-acetamido-2-cyclopentyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide?
2-acetamido-2-cyclopentyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide has a molecular weight of 343.47 g/mol, XLogP of 2.60, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamido-2-cyclopentyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide is sourced from PubChem (CID 55981326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).