2-cyclopentyl-N-(furan-2-ylmethyl)-2-[4-(2-phenylacetyl)piperazin-1-yl]acetamide

C24H31N3O3 — CID 42842454

IUPAC2-cyclopentyl-N-(furan-2-ylmethyl)-2-[4-(2-phenylacetyl)piperazin-1-yl]acetamide
SMILESO=C(NCc1ccco1)C(C1CCCC1)N1CCN(C(=O)Cc2ccccc2)CC1
InChIInChI=1S/C24H31N3O3/c28-22(17-19-7-2-1-3-8-19)26-12-14-27(15-13-26)23(20-9-4-5-10-20)24(29)25-18-21-11-6-16-30-21/h1-3,6-8,11,16,20,23H,4-5,9-10,12-15,17-18H2,(H,25,29)
InChIKeyQCXBMUFBSNFLDU-UHFFFAOYSA-N
MW409.53 g/mol
LogP2.84
Rot. Bonds7

About 2-cyclopentyl-N-(furan-2-ylmethyl)-2-[4-(2-phenylacetyl)piperazin-1-yl]acetamide

2-cyclopentyl-N-(furan-2-ylmethyl)-2-[4-(2-phenylacetyl)piperazin-1-yl]acetamide (PubChem CID 42842454) has the molecular formula C24H31N3O3 and a molecular weight of 409.53 g/mol. Its IUPAC name is 2-cyclopentyl-N-(furan-2-ylmethyl)-2-[4-(2-phenylacetyl)piperazin-1-yl]acetamide.

Molecular Properties

Compound Name2-cyclopentyl-N-(furan-2-ylmethyl)-2-[4-(2-phenylacetyl)piperazin-1-yl]acetamide
PubChem CID42842454
Molecular FormulaC24H31N3O3
Molecular Weight409.53 g/mol
Exact Mass409.24
IUPAC Name2-cyclopentyl-N-(furan-2-ylmethyl)-2-[4-(2-phenylacetyl)piperazin-1-yl]acetamide
SMILESO=C(NCc1ccco1)C(C1CCCC1)N1CCN(C(=O)Cc2ccccc2)CC1
InChIInChI=1S/C24H31N3O3/c28-22(17-19-7-2-1-3-8-19)26-12-14-27(15-13-26)23(20-9-4-5-10-20)24(29)25-18-21-11-6-16-30-21/h1-3,6-8,11,16,20,23H,4-5,9-10,12-15,17-18H2,(H,25,29)
InChIKeyQCXBMUFBSNFLDU-UHFFFAOYSA-N
XLogP2.84
TPSA65.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500409.53
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-(2-chlorobenzoyl)piperazin-1-yl]-2-cyclopentyl-N-(furan-2-ylmethyl)acetamide
CID 46024261
2-[4-[2-(4-chlorophenoxy)acetyl]piperazin-1-yl]-2-cyclopentyl-N-(furan-2-ylmethyl)acetamide
CID 42842453
(2R)-2-cyclopentyl-N-(furan-2-ylmethyl)-2-[4-(2-methoxybenzoyl)piperazin-1-yl]acetamide
CID 93209043
4-[(1S)-1-cyclopentyl-2-(furan-2-ylmethylamino)-2-oxoethyl]-N-(4-methoxyphenyl)piperazine-1-carboxamide
CID 93221172
2-cyclopentyl-N-ethyl-2-[4-(3-phenylpropanoyl)piperazin-1-yl]acetamide
CID 46024721
(2S)-2-cyclopentyl-N-ethyl-2-[4-(3-phenylpropanoyl)piperazin-1-yl]acetamide
CID 93210620
2-cyclopentyl-2-[4-(2-phenylacetyl)piperazin-1-yl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
CID 46024335
2-cyclopentyl-2-[4-(3-methylbutanoyl)piperazin-1-yl]-N-(2-phenylethyl)acetamide
CID 24719942
(2S)-2-cyclopentyl-N-(cyclopropylmethyl)-2-[4-(3-phenylpropanoyl)piperazin-1-yl]acetamide
CID 93210063
N-benzyl-2-[4-[2-(4-chlorophenoxy)acetyl]piperazin-1-yl]-2-cyclopentylacetamide
CID 42842468
(2R)-2-cyclopentyl-N-[(3-fluorophenyl)methyl]-2-[4-(2-thiophen-2-ylacetyl)piperazin-1-yl]acetamide
CID 93210253
(2S)-2-cyclopentyl-2-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]-N-(2-phenylethyl)acetamide
CID 93209356

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-N-(furan-2-ylmethyl)-2-[4-(2-phenylacetyl)piperazin-1-yl]acetamide?
The IUPAC name of 2-cyclopentyl-N-(furan-2-ylmethyl)-2-[4-(2-phenylacetyl)piperazin-1-yl]acetamide (CID 42842454) is 2-cyclopentyl-N-(furan-2-ylmethyl)-2-[4-(2-phenylacetyl)piperazin-1-yl]acetamide.
What is the SMILES notation for 2-cyclopentyl-N-(furan-2-ylmethyl)-2-[4-(2-phenylacetyl)piperazin-1-yl]acetamide?
The canonical SMILES for 2-cyclopentyl-N-(furan-2-ylmethyl)-2-[4-(2-phenylacetyl)piperazin-1-yl]acetamide is O=C(NCc1ccco1)C(C1CCCC1)N1CCN(C(=O)Cc2ccccc2)CC1.
What is the InChIKey of 2-cyclopentyl-N-(furan-2-ylmethyl)-2-[4-(2-phenylacetyl)piperazin-1-yl]acetamide?
The InChIKey is QCXBMUFBSNFLDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H31N3O3/c28-22(17-19-7-2-1-3-8-19)26-12-14-27(15-13-26)23(20-9-4-5-10-20)24(29)25-18-21-11-6-16-30-21/h1-3,6-8,11,16,20,23H,4-5,9-10,12-15,17-18H2,(H,25,29).
What are the key properties of 2-cyclopentyl-N-(furan-2-ylmethyl)-2-[4-(2-phenylacetyl)piperazin-1-yl]acetamide?
2-cyclopentyl-N-(furan-2-ylmethyl)-2-[4-(2-phenylacetyl)piperazin-1-yl]acetamide has a molecular weight of 409.53 g/mol, XLogP of 2.84, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-N-(furan-2-ylmethyl)-2-[4-(2-phenylacetyl)piperazin-1-yl]acetamide is sourced from PubChem (CID 42842454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).