2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-cyclopentyl-N-(2-pyridin-2-ylethyl)acetamide

C24H36N4O2 — CID 42842428

IUPAC2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-cyclopentyl-N-(2-pyridin-2-ylethyl)acetamide
SMILESO=C(NCCc1ccccn1)C(C1CCCC1)N1CCN(C(=O)C2CCCC2)CC1
InChIInChI=1S/C24H36N4O2/c29-23(26-14-12-21-11-5-6-13-25-21)22(19-7-1-2-8-19)27-15-17-28(18-16-27)24(30)20-9-3-4-10-20/h5-6,11,13,19-20,22H,1-4,7-10,12,14-18H2,(H,26,29)
InChIKeyNDXFLGQMBIPQFJ-UHFFFAOYSA-N
MW412.58 g/mol
LogP2.63
Rot. Bonds7

About 2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-cyclopentyl-N-(2-pyridin-2-ylethyl)acetamide

2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-cyclopentyl-N-(2-pyridin-2-ylethyl)acetamide (PubChem CID 42842428) has the molecular formula C24H36N4O2 and a molecular weight of 412.58 g/mol. Its IUPAC name is 2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-cyclopentyl-N-(2-pyridin-2-ylethyl)acetamide.

Molecular Properties

Compound Name2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-cyclopentyl-N-(2-pyridin-2-ylethyl)acetamide
PubChem CID42842428
Molecular FormulaC24H36N4O2
Molecular Weight412.58 g/mol
Exact Mass412.28
IUPAC Name2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-cyclopentyl-N-(2-pyridin-2-ylethyl)acetamide
SMILESO=C(NCCc1ccccn1)C(C1CCCC1)N1CCN(C(=O)C2CCCC2)CC1
InChIInChI=1S/C24H36N4O2/c29-23(26-14-12-21-11-5-6-13-25-21)22(19-7-1-2-8-19)27-15-17-28(18-16-27)24(30)20-9-3-4-10-20/h5-6,11,13,19-20,22H,1-4,7-10,12,14-18H2,(H,26,29)
InChIKeyNDXFLGQMBIPQFJ-UHFFFAOYSA-N
XLogP2.63
TPSA65.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.58
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyclopentyl-2-[4-(2-methylbenzoyl)piperazin-1-yl]-N-(2-pyridin-2-ylethyl)acetamide
CID 46152900
2-[4-[2-(4-chlorophenoxy)acetyl]piperazin-1-yl]-2-cyclopentyl-N-(2-pyridin-2-ylethyl)acetamide
CID 46024203
(2R)-2-cyclopentyl-2-[4-(3-methylbutanoyl)piperazin-1-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 93209571
4-[(1S)-1-cyclopentyl-2-oxo-2-(pyridin-2-ylmethylamino)ethyl]-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide
CID 93221257
(2R)-2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-cyclopentyl-N-(pyridin-3-ylmethyl)acetamide
CID 93209658
4-[1-cyclopentyl-2-oxo-2-(pyridin-2-ylmethylamino)ethyl]-N-(4-fluorophenyl)piperazine-1-carboxamide
CID 46027247
2-cyclopentyl-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-(pyridin-3-ylmethyl)acetamide
CID 46024445
2-[4-(cyclobutanecarbonyl)piperazin-1-yl]-2-cyclopentyl-N-[2-(dimethylamino)ethyl]acetamide
CID 24719226
N-(2-pyridin-2-ylethyl)cyclopentanecarboxamide
CID 110872250
2-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]ethyl]-1-(2-pyridin-2-ylethyl)guanidine
CID 111567241
2-cyclopentyl-2-[4-(3-methoxybenzoyl)piperazin-1-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 46024433
2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-cyclopentyl-N-methylacetamide
CID 24719259

Frequently Asked Questions

What is the IUPAC name of 2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-cyclopentyl-N-(2-pyridin-2-ylethyl)acetamide?
The IUPAC name of 2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-cyclopentyl-N-(2-pyridin-2-ylethyl)acetamide (CID 42842428) is 2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-cyclopentyl-N-(2-pyridin-2-ylethyl)acetamide.
What is the SMILES notation for 2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-cyclopentyl-N-(2-pyridin-2-ylethyl)acetamide?
The canonical SMILES for 2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-cyclopentyl-N-(2-pyridin-2-ylethyl)acetamide is O=C(NCCc1ccccn1)C(C1CCCC1)N1CCN(C(=O)C2CCCC2)CC1.
What is the InChIKey of 2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-cyclopentyl-N-(2-pyridin-2-ylethyl)acetamide?
The InChIKey is NDXFLGQMBIPQFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H36N4O2/c29-23(26-14-12-21-11-5-6-13-25-21)22(19-7-1-2-8-19)27-15-17-28(18-16-27)24(30)20-9-3-4-10-20/h5-6,11,13,19-20,22H,1-4,7-10,12,14-18H2,(H,26,29).
What are the key properties of 2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-cyclopentyl-N-(2-pyridin-2-ylethyl)acetamide?
2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-cyclopentyl-N-(2-pyridin-2-ylethyl)acetamide has a molecular weight of 412.58 g/mol, XLogP of 2.63, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-cyclopentyl-N-(2-pyridin-2-ylethyl)acetamide is sourced from PubChem (CID 42842428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).