2-[4-[(2R)-2-aminopropanoyl]piperazin-1-yl]-N-cyclohexylacetamide;dihydrochloride

C15H30Cl2N4O2 — CID 119876862

IUPAC2-[4-[(2R)-2-aminopropanoyl]piperazin-1-yl]-N-cyclohexylacetamide;dihydrochloride
SMILESC[C@@H](N)C(=O)N1CCN(CC(=O)NC2CCCCC2)CC1.Cl.Cl
InChIInChI=1S/C15H28N4O2.2ClH/c1-12(16)15(21)19-9-7-18(8-10-19)11-14(20)17-13-5-3-2-4-6-13;;/h12-13H,2-11,16H2,1H3,(H,17,20);2*1H/t12-;;/m1../s1
InChIKeyLPIZTYCJIDCKLD-CURYUGHLSA-N
MW369.34 g/mol
LogP0.77
Rot. Bonds4

About 2-[4-[(2R)-2-aminopropanoyl]piperazin-1-yl]-N-cyclohexylacetamide;dihydrochloride

2-[4-[(2R)-2-aminopropanoyl]piperazin-1-yl]-N-cyclohexylacetamide;dihydrochloride (PubChem CID 119876862) has the molecular formula C15H30Cl2N4O2 and a molecular weight of 369.34 g/mol. Its IUPAC name is 2-[4-[(2R)-2-aminopropanoyl]piperazin-1-yl]-N-cyclohexylacetamide;dihydrochloride.

Molecular Properties

Compound Name2-[4-[(2R)-2-aminopropanoyl]piperazin-1-yl]-N-cyclohexylacetamide;dihydrochloride
PubChem CID119876862
Molecular FormulaC15H30Cl2N4O2
Molecular Weight369.34 g/mol
Exact Mass368.17
IUPAC Name2-[4-[(2R)-2-aminopropanoyl]piperazin-1-yl]-N-cyclohexylacetamide;dihydrochloride
SMILESC[C@@H](N)C(=O)N1CCN(CC(=O)NC2CCCCC2)CC1.Cl.Cl
InChIInChI=1S/C15H28N4O2.2ClH/c1-12(16)15(21)19-9-7-18(8-10-19)11-14(20)17-13-5-3-2-4-6-13;;/h12-13H,2-11,16H2,1H3,(H,17,20);2*1H/t12-;;/m1../s1
InChIKeyLPIZTYCJIDCKLD-CURYUGHLSA-N
XLogP0.77
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.34
LogP ≤ 50.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-[(2S)-2-amino-3,3-dimethylbutanoyl]piperazin-1-yl]-N-cyclohexylacetamide
CID 119876865
2-[4-[2-amino-2-(4-methylphenyl)acetyl]piperazin-1-yl]-N-cyclohexylacetamide;dihydrochloride
CID 120670145
2-[4-(3-amino-2-methylbutanoyl)piperazin-1-yl]-N-(4-methylcyclohexyl)acetamide;dihydrochloride
CID 120503708
2-[4-[(2S)-2-(azepan-1-yl)propanoyl]piperazin-1-yl]-N-cyclopropylacetamide
CID 95934647
4-[2-(cyclohexylamino)-2-oxoethyl]piperazine-1-carbothioic S-acid
CID 132941398
2-[3-(1-aminoethyl)piperidin-1-yl]-N-cycloheptylacetamide;hydrochloride
CID 119925682
2-[4-[(2R)-2-aminopropanoyl]piperazin-1-yl]-N-cyclopentylpropanamide
CID 119877479
N-cyclopropyl-2-[4-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)piperazin-1-yl]acetamide
CID 127274229
2-[4-[(2R)-2-aminopropanoyl]piperazin-1-yl]-N-ethylacetamide
CID 54995847
3-[4-[2-(cyclopentylamino)-2-oxoethyl]piperazin-1-yl]-2-methylpropanoic acid
CID 82323003
2-[4-[(2S,5R)-5-(aminomethyl)oxolane-2-carbonyl]piperazin-1-yl]-N-cyclohexylacetamide;dihydrochloride
CID 120799929
2-[4-(3-aminobutanoyl)piperazin-1-yl]-N-(3-methylcyclohexyl)acetamide;dihydrochloride
CID 119876812

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(2R)-2-aminopropanoyl]piperazin-1-yl]-N-cyclohexylacetamide;dihydrochloride?
The IUPAC name of 2-[4-[(2R)-2-aminopropanoyl]piperazin-1-yl]-N-cyclohexylacetamide;dihydrochloride (CID 119876862) is 2-[4-[(2R)-2-aminopropanoyl]piperazin-1-yl]-N-cyclohexylacetamide;dihydrochloride.
What is the SMILES notation for 2-[4-[(2R)-2-aminopropanoyl]piperazin-1-yl]-N-cyclohexylacetamide;dihydrochloride?
The canonical SMILES for 2-[4-[(2R)-2-aminopropanoyl]piperazin-1-yl]-N-cyclohexylacetamide;dihydrochloride is C[C@@H](N)C(=O)N1CCN(CC(=O)NC2CCCCC2)CC1.Cl.Cl.
What is the InChIKey of 2-[4-[(2R)-2-aminopropanoyl]piperazin-1-yl]-N-cyclohexylacetamide;dihydrochloride?
The InChIKey is LPIZTYCJIDCKLD-CURYUGHLSA-N. The full InChI is InChI=1S/C15H28N4O2.2ClH/c1-12(16)15(21)19-9-7-18(8-10-19)11-14(20)17-13-5-3-2-4-6-13;;/h12-13H,2-11,16H2,1H3,(H,17,20);2*1H/t12-;;/m1../s1.
What are the key properties of 2-[4-[(2R)-2-aminopropanoyl]piperazin-1-yl]-N-cyclohexylacetamide;dihydrochloride?
2-[4-[(2R)-2-aminopropanoyl]piperazin-1-yl]-N-cyclohexylacetamide;dihydrochloride has a molecular weight of 369.34 g/mol, XLogP of 0.77, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(2R)-2-aminopropanoyl]piperazin-1-yl]-N-cyclohexylacetamide;dihydrochloride is sourced from PubChem (CID 119876862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).