N-butan-2-yl-2-cyclopentyl-2-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]acetamide

C20H37N3O2 — CID 42842489

IUPACN-butan-2-yl-2-cyclopentyl-2-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]acetamide
SMILESCCC(C)NC(=O)C(C1CCCC1)N1CCN(C(=O)C(C)(C)C)CC1
InChIInChI=1S/C20H37N3O2/c1-6-15(2)21-18(24)17(16-9-7-8-10-16)22-11-13-23(14-12-22)19(25)20(3,4)5/h15-17H,6-14H2,1-5H3,(H,21,24)
InChIKeyHZDLTZICHLRXCY-UHFFFAOYSA-N
MW351.54 g/mol
LogP2.65
Rot. Bonds5

About N-butan-2-yl-2-cyclopentyl-2-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]acetamide

N-butan-2-yl-2-cyclopentyl-2-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]acetamide (PubChem CID 42842489) has the molecular formula C20H37N3O2 and a molecular weight of 351.54 g/mol. Its IUPAC name is N-butan-2-yl-2-cyclopentyl-2-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]acetamide.

Molecular Properties

Compound NameN-butan-2-yl-2-cyclopentyl-2-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]acetamide
PubChem CID42842489
Molecular FormulaC20H37N3O2
Molecular Weight351.54 g/mol
Exact Mass351.29
IUPAC NameN-butan-2-yl-2-cyclopentyl-2-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]acetamide
SMILESCCC(C)NC(=O)C(C1CCCC1)N1CCN(C(=O)C(C)(C)C)CC1
InChIInChI=1S/C20H37N3O2/c1-6-15(2)21-18(24)17(16-9-7-8-10-16)22-11-13-23(14-12-22)19(25)20(3,4)5/h15-17H,6-14H2,1-5H3,(H,21,24)
InChIKeyHZDLTZICHLRXCY-UHFFFAOYSA-N
XLogP2.65
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.54
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-butan-2-yl-2-cyclopentyl-2-[4-(2-methoxyacetyl)piperazin-1-yl]acetamide
CID 42842484
2-cyclopentyl-2-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]-N-(1-phenylethyl)acetamide
CID 42842520
N-butan-2-yl-2-cyclopentyl-2-[4-(2,4-dichlorobenzoyl)piperazin-1-yl]acetamide
CID 46024308
2-[4-(1,3-benzodioxole-5-carbonyl)piperazin-1-yl]-N-butan-2-yl-2-cyclopentylacetamide
CID 42842485
(2R)-2-cyclopentyl-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-[(2S)-2-methylbutyl]acetamide
CID 93209950
2,2-dimethyl-1-[4-(pentan-2-ylamino)piperidin-1-yl]propan-1-one
CID 43747722
2-cyclopentyl-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-(2-methylpropyl)acetamide
CID 24719909
1-[4-(1-hydroxypropyl)piperidin-1-yl]-2,2-dimethylpropan-1-one
CID 112537597
N-butan-2-yl-2-[[(1S)-1-cyclopentylethyl]amino]propanamide
CID 81396140
(2R)-2-cyclopentyl-2-[4-(2-methylpropanoyl)piperazin-1-yl]-N-[(1R)-1-phenylethyl]acetamide
CID 93209177
N-(cyclohexylmethyl)-2-cyclopentyl-2-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]acetamide
CID 24719206
2-[4-(4-chlorobenzoyl)piperazin-1-yl]-2-cyclopentyl-N-propan-2-ylacetamide
CID 42842473

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-2-cyclopentyl-2-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]acetamide?
The IUPAC name of N-butan-2-yl-2-cyclopentyl-2-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]acetamide (CID 42842489) is N-butan-2-yl-2-cyclopentyl-2-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]acetamide.
What is the SMILES notation for N-butan-2-yl-2-cyclopentyl-2-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]acetamide?
The canonical SMILES for N-butan-2-yl-2-cyclopentyl-2-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]acetamide is CCC(C)NC(=O)C(C1CCCC1)N1CCN(C(=O)C(C)(C)C)CC1.
What is the InChIKey of N-butan-2-yl-2-cyclopentyl-2-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]acetamide?
The InChIKey is HZDLTZICHLRXCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H37N3O2/c1-6-15(2)21-18(24)17(16-9-7-8-10-16)22-11-13-23(14-12-22)19(25)20(3,4)5/h15-17H,6-14H2,1-5H3,(H,21,24).
What are the key properties of N-butan-2-yl-2-cyclopentyl-2-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]acetamide?
N-butan-2-yl-2-cyclopentyl-2-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]acetamide has a molecular weight of 351.54 g/mol, XLogP of 2.65, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-2-cyclopentyl-2-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]acetamide is sourced from PubChem (CID 42842489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).