(2R)-2-cyclopentyl-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-[(2S)-2-methylbutyl]acetamide

C20H35N3O2 — CID 93209950

IUPAC(2R)-2-cyclopentyl-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-[(2S)-2-methylbutyl]acetamide
SMILESCC[C@H](C)CNC(=O)[C@@H](C1CCCC1)N1CCN(C(=O)C2CC2)CC1
InChIInChI=1S/C20H35N3O2/c1-3-15(2)14-21-19(24)18(16-6-4-5-7-16)22-10-12-23(13-11-22)20(25)17-8-9-17/h15-18H,3-14H2,1-2H3,(H,21,24)/t15-,18+/m0/s1
InChIKeyHSMGLVBDXKRMRW-MAUKXSAKSA-N
MW349.52 g/mol
LogP2.26
Rot. Bonds7

About (2R)-2-cyclopentyl-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-[(2S)-2-methylbutyl]acetamide

(2R)-2-cyclopentyl-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-[(2S)-2-methylbutyl]acetamide (PubChem CID 93209950) has the molecular formula C20H35N3O2 and a molecular weight of 349.52 g/mol. Its IUPAC name is (2R)-2-cyclopentyl-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-[(2S)-2-methylbutyl]acetamide.

Molecular Properties

Compound Name(2R)-2-cyclopentyl-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-[(2S)-2-methylbutyl]acetamide
PubChem CID93209950
Molecular FormulaC20H35N3O2
Molecular Weight349.52 g/mol
Exact Mass349.27
IUPAC Name(2R)-2-cyclopentyl-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-[(2S)-2-methylbutyl]acetamide
SMILESCC[C@H](C)CNC(=O)[C@@H](C1CCCC1)N1CCN(C(=O)C2CC2)CC1
InChIInChI=1S/C20H35N3O2/c1-3-15(2)14-21-19(24)18(16-6-4-5-7-16)22-10-12-23(13-11-22)20(25)17-8-9-17/h15-18H,3-14H2,1-2H3,(H,21,24)/t15-,18+/m0/s1
InChIKeyHSMGLVBDXKRMRW-MAUKXSAKSA-N
XLogP2.26
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.52
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2R)-2-cyclopentyl-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-[(2S)-2-methylbutyl]acetamide with MolForge

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Related Compounds

4-(Cyclopentanecarbonyl)piperazin-2-one
CID 833668
N-[(2S)-1-[3-[4-(3-aminopropylamino)butylamino]propylamino]-3-cyclohexyl-1-oxopropan-2-yl]cyclopentanecarboxamide
CID 155529699
N-[1-({2-[butyl(methyl)amino]ethyl}amino)-3-methyl-1-oxobutan-2-yl]-4-methylcyclohexanecarboxamide
CID 16187659
3-(1-butyryl-4-piperidinyl)-N-cyclopropylpropanamide
CID 24816634
Alaptide
CID 119329
8-Methyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 541931
Cyclohexanecarboxylic acid {1-[(cyclohexyl-methyl-carbamoyl)-methyl]-piperidin-4-yl}-amide
CID 6603003
(S)-N-(1-(3-(4-(3-aminopropylamino)butylamino)propylamino)-3-cyclohexyl-1-oxopropan-2-yl)cyclopropanecarboxamide
CID 49788655
N-(1-{[(1-ethylpyrrolidin-2-yl)methyl]amino}-3-methyl-1-oxobutan-2-yl)-4-methylcyclohexanecarboxamide
CID 3240291
1-[(N-acetylglycyl)amino]-N-cyclopentylcyclohexanecarboxamide
CID 3242198
4-methyl-N-[3-methyl-1-oxo-1-(4-piperidin-1-ylpiperidin-1-yl)butan-2-yl]cyclohexane-1-carboxamide
CID 3238870
4-methyl-N-(3-methyl-1-{[2-(4-methylpiperidin-1-yl)ethyl]amino}-1-oxobutan-2-yl)cyclohexanecarboxamide
CID 3243893

Frequently Asked Questions

What is the IUPAC name of (2R)-2-cyclopentyl-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-[(2S)-2-methylbutyl]acetamide?
The IUPAC name of (2R)-2-cyclopentyl-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-[(2S)-2-methylbutyl]acetamide (CID 93209950) is (2R)-2-cyclopentyl-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-[(2S)-2-methylbutyl]acetamide.
What is the SMILES notation for (2R)-2-cyclopentyl-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-[(2S)-2-methylbutyl]acetamide?
The canonical SMILES for (2R)-2-cyclopentyl-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-[(2S)-2-methylbutyl]acetamide is CC[C@H](C)CNC(=O)[C@@H](C1CCCC1)N1CCN(C(=O)C2CC2)CC1.
What is the InChIKey of (2R)-2-cyclopentyl-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-[(2S)-2-methylbutyl]acetamide?
The InChIKey is HSMGLVBDXKRMRW-MAUKXSAKSA-N. The full InChI is InChI=1S/C20H35N3O2/c1-3-15(2)14-21-19(24)18(16-6-4-5-7-16)22-10-12-23(13-11-22)20(25)17-8-9-17/h15-18H,3-14H2,1-2H3,(H,21,24)/t15-,18+/m0/s1.
What are the key properties of (2R)-2-cyclopentyl-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-[(2S)-2-methylbutyl]acetamide?
(2R)-2-cyclopentyl-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-[(2S)-2-methylbutyl]acetamide has a molecular weight of 349.52 g/mol, XLogP of 2.26, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-cyclopentyl-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-[(2S)-2-methylbutyl]acetamide is sourced from PubChem (CID 93209950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).