N-[2-[4-(dimethylamino)piperidin-1-yl]ethyl]-2-pyrrolidin-2-ylacetamide

C15H30N4O — CID 119895457

IUPACN-[2-[4-(dimethylamino)piperidin-1-yl]ethyl]-2-pyrrolidin-2-ylacetamide
SMILESCN(C)C1CCN(CCNC(=O)CC2CCCN2)CC1
InChIInChI=1S/C15H30N4O/c1-18(2)14-5-9-19(10-6-14)11-8-17-15(20)12-13-4-3-7-16-13/h13-14,16H,3-12H2,1-2H3,(H,17,20)
InChIKeyMTTVVQPAPWCVJN-UHFFFAOYSA-N
MW282.43 g/mol
LogP0.27
Rot. Bonds6

About N-[2-[4-(dimethylamino)piperidin-1-yl]ethyl]-2-pyrrolidin-2-ylacetamide

N-[2-[4-(dimethylamino)piperidin-1-yl]ethyl]-2-pyrrolidin-2-ylacetamide (PubChem CID 119895457) has the molecular formula C15H30N4O and a molecular weight of 282.43 g/mol. Its IUPAC name is N-[2-[4-(dimethylamino)piperidin-1-yl]ethyl]-2-pyrrolidin-2-ylacetamide.

Molecular Properties

Compound NameN-[2-[4-(dimethylamino)piperidin-1-yl]ethyl]-2-pyrrolidin-2-ylacetamide
PubChem CID119895457
Molecular FormulaC15H30N4O
Molecular Weight282.43 g/mol
Exact Mass282.24
IUPAC NameN-[2-[4-(dimethylamino)piperidin-1-yl]ethyl]-2-pyrrolidin-2-ylacetamide
SMILESCN(C)C1CCN(CCNC(=O)CC2CCCN2)CC1
InChIInChI=1S/C15H30N4O/c1-18(2)14-5-9-19(10-6-14)11-8-17-15(20)12-13-4-3-7-16-13/h13-14,16H,3-12H2,1-2H3,(H,17,20)
InChIKeyMTTVVQPAPWCVJN-UHFFFAOYSA-N
XLogP0.27
TPSA47.61 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 50.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-piperidin-1-ylethyl)-2-pyrrolidin-2-ylacetamide
CID 54967426
N-[2-[4-(dimethylamino)piperidin-1-yl]ethyl]pyrrolidine-2-carboxamide
CID 119895451
N-[2-(3-methylpiperidin-1-yl)ethyl]-2-pyrrolidin-2-ylacetamide
CID 119851043
2-pyrrolidin-2-yl-N-(3-pyrrolidin-1-ylpropyl)acetamide;dihydrochloride
CID 119835586
N-[[1-[2-(dimethylamino)ethyl]piperidin-4-yl]methyl]-2-pyrrolidin-2-ylacetamide
CID 119862739
N-[4-(4-ethylpiperazin-1-yl)butyl]-2-pyrrolidin-2-ylacetamide;trihydrochloride
CID 119902055
N,N-dimethyl-3-[(2-pyrrolidin-2-ylacetyl)amino]propanamide;hydrochloride
CID 119731272
N,N-dimethyl-1-(2-pyrrolidin-2-ylethyl)piperidin-4-amine
CID 61364502
N-(2-methylsulfinylethyl)-2-pyrrolidin-2-ylacetamide
CID 115739238
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-[4-(dimethylamino)piperidin-1-yl]ethyl]acetamide
CID 119895441
N-[2-(1-methylpiperidin-4-yl)ethyl]-2-pyrrolidin-2-ylacetamide
CID 113267487
N-[2-(4-methylpiperidin-1-yl)ethyl]-2-thiomorpholin-3-ylacetamide
CID 66420689

Frequently Asked Questions

What is the IUPAC name of N-[2-[4-(dimethylamino)piperidin-1-yl]ethyl]-2-pyrrolidin-2-ylacetamide?
The IUPAC name of N-[2-[4-(dimethylamino)piperidin-1-yl]ethyl]-2-pyrrolidin-2-ylacetamide (CID 119895457) is N-[2-[4-(dimethylamino)piperidin-1-yl]ethyl]-2-pyrrolidin-2-ylacetamide.
What is the SMILES notation for N-[2-[4-(dimethylamino)piperidin-1-yl]ethyl]-2-pyrrolidin-2-ylacetamide?
The canonical SMILES for N-[2-[4-(dimethylamino)piperidin-1-yl]ethyl]-2-pyrrolidin-2-ylacetamide is CN(C)C1CCN(CCNC(=O)CC2CCCN2)CC1.
What is the InChIKey of N-[2-[4-(dimethylamino)piperidin-1-yl]ethyl]-2-pyrrolidin-2-ylacetamide?
The InChIKey is MTTVVQPAPWCVJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N4O/c1-18(2)14-5-9-19(10-6-14)11-8-17-15(20)12-13-4-3-7-16-13/h13-14,16H,3-12H2,1-2H3,(H,17,20).
What are the key properties of N-[2-[4-(dimethylamino)piperidin-1-yl]ethyl]-2-pyrrolidin-2-ylacetamide?
N-[2-[4-(dimethylamino)piperidin-1-yl]ethyl]-2-pyrrolidin-2-ylacetamide has a molecular weight of 282.43 g/mol, XLogP of 0.27, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-(dimethylamino)piperidin-1-yl]ethyl]-2-pyrrolidin-2-ylacetamide is sourced from PubChem (CID 119895457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).