(2R)-N-cyclohexyl-2-[4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-yl]propanamide

C17H32N4O2 — CID 30988484

IUPAC(2R)-N-cyclohexyl-2-[4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-yl]propanamide
SMILESC[C@H](C(=O)NC1CCCCC1)N1CCN(CC(=O)N(C)C)CC1
InChIInChI=1S/C17H32N4O2/c1-14(17(23)18-15-7-5-4-6-8-15)21-11-9-20(10-12-21)13-16(22)19(2)3/h14-15H,4-13H2,1-3H3,(H,18,23)/t14-/m1/s1
InChIKeyAXRQBILHHYCTNK-CQSZACIVSA-N
MW324.47 g/mol
LogP0.53
Rot. Bonds5

About (2R)-N-cyclohexyl-2-[4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-yl]propanamide

(2R)-N-cyclohexyl-2-[4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-yl]propanamide (PubChem CID 30988484) has the molecular formula C17H32N4O2 and a molecular weight of 324.47 g/mol. Its IUPAC name is (2R)-N-cyclohexyl-2-[4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-yl]propanamide.

Molecular Properties

Compound Name(2R)-N-cyclohexyl-2-[4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-yl]propanamide
PubChem CID30988484
Molecular FormulaC17H32N4O2
Molecular Weight324.47 g/mol
Exact Mass324.25
IUPAC Name(2R)-N-cyclohexyl-2-[4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-yl]propanamide
SMILESC[C@H](C(=O)NC1CCCCC1)N1CCN(CC(=O)N(C)C)CC1
InChIInChI=1S/C17H32N4O2/c1-14(17(23)18-15-7-5-4-6-8-15)21-11-9-20(10-12-21)13-16(22)19(2)3/h14-15H,4-13H2,1-3H3,(H,18,23)/t14-/m1/s1
InChIKeyAXRQBILHHYCTNK-CQSZACIVSA-N
XLogP0.53
TPSA55.89 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.47
LogP ≤ 50.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclohexyl-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]propanamide
CID 55461906
N-cyclopentyl-2-[4-(2-morpholin-4-yl-2-oxoethyl)piperazin-1-yl]propanamide
CID 128951171
(2S)-2-[4-[2-[2-cyanopropan-2-yl(methyl)amino]-2-oxoethyl]piperazin-1-yl]-N-cyclopropylpropanamide
CID 31689440
2-[4-(cycloheptylamino)piperidin-1-yl]-N,N-dimethylacetamide
CID 43767045
2-[4-(cyclohexylamino)piperidin-1-yl]-N,N-dimethylacetamide
CID 43755989
N-carbamoyl-2-[4-[2-(dimethylamino)-2-oxoethyl]-1,4-diazepan-1-yl]propanamide
CID 46444317
(2S)-N-cyclopentyl-2-[4-(piperidin-4-ylmethyl)piperazin-1-yl]propanamide
CID 124612749
2-(4-acetylpiperazin-1-yl)-N-cyclopentylpropanamide
CID 123939055
methyl (2R)-2-[4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-yl]propanoate
CID 94526452
(2S)-2-(4-benzylpiperazin-1-yl)-N-cyclohexylpropanamide
CID 51613241
(2S)-N-cyclohexyl-2-[4-[2-(4-fluoroanilino)-2-oxoethyl]piperazin-1-yl]propanamide
CID 51626907
(2R)-N-cyclohexyl-2-[4-[2-(2,6-dimethylanilino)-2-oxoethyl]piperazin-1-yl]propanamide
CID 51627460

Frequently Asked Questions

What is the IUPAC name of (2R)-N-cyclohexyl-2-[4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-yl]propanamide?
The IUPAC name of (2R)-N-cyclohexyl-2-[4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-yl]propanamide (CID 30988484) is (2R)-N-cyclohexyl-2-[4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-yl]propanamide.
What is the SMILES notation for (2R)-N-cyclohexyl-2-[4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-yl]propanamide?
The canonical SMILES for (2R)-N-cyclohexyl-2-[4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-yl]propanamide is C[C@H](C(=O)NC1CCCCC1)N1CCN(CC(=O)N(C)C)CC1.
What is the InChIKey of (2R)-N-cyclohexyl-2-[4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-yl]propanamide?
The InChIKey is AXRQBILHHYCTNK-CQSZACIVSA-N. The full InChI is InChI=1S/C17H32N4O2/c1-14(17(23)18-15-7-5-4-6-8-15)21-11-9-20(10-12-21)13-16(22)19(2)3/h14-15H,4-13H2,1-3H3,(H,18,23)/t14-/m1/s1.
What are the key properties of (2R)-N-cyclohexyl-2-[4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-yl]propanamide?
(2R)-N-cyclohexyl-2-[4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-yl]propanamide has a molecular weight of 324.47 g/mol, XLogP of 0.53, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-cyclohexyl-2-[4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-yl]propanamide is sourced from PubChem (CID 30988484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).