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

C16H32N4O — CID 119862739

IUPACN-[[1-[2-(dimethylamino)ethyl]piperidin-4-yl]methyl]-2-pyrrolidin-2-ylacetamide
SMILESCN(C)CCN1CCC(CNC(=O)CC2CCCN2)CC1
InChIInChI=1S/C16H32N4O/c1-19(2)10-11-20-8-5-14(6-9-20)13-18-16(21)12-15-4-3-7-17-15/h14-15,17H,3-13H2,1-2H3,(H,18,21)
InChIKeyTVDSVNKINRCUAN-UHFFFAOYSA-N
MW296.46 g/mol
LogP0.52
Rot. Bonds7

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

N-[[1-[2-(dimethylamino)ethyl]piperidin-4-yl]methyl]-2-pyrrolidin-2-ylacetamide (PubChem CID 119862739) has the molecular formula C16H32N4O and a molecular weight of 296.46 g/mol. Its IUPAC name is N-[[1-[2-(dimethylamino)ethyl]piperidin-4-yl]methyl]-2-pyrrolidin-2-ylacetamide.

Molecular Properties

Compound NameN-[[1-[2-(dimethylamino)ethyl]piperidin-4-yl]methyl]-2-pyrrolidin-2-ylacetamide
PubChem CID119862739
Molecular FormulaC16H32N4O
Molecular Weight296.46 g/mol
Exact Mass296.26
IUPAC NameN-[[1-[2-(dimethylamino)ethyl]piperidin-4-yl]methyl]-2-pyrrolidin-2-ylacetamide
SMILESCN(C)CCN1CCC(CNC(=O)CC2CCCN2)CC1
InChIInChI=1S/C16H32N4O/c1-19(2)10-11-20-8-5-14(6-9-20)13-18-16(21)12-15-4-3-7-17-15/h14-15,17H,3-13H2,1-2H3,(H,18,21)
InChIKeyTVDSVNKINRCUAN-UHFFFAOYSA-N
XLogP0.52
TPSA47.61 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.46
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(cyclopentylmethyl)-2-pyrrolidin-2-ylacetamide
CID 61370022
N-(cyclobutylmethyl)-2-pyrrolidin-2-ylacetamide
CID 61372732
N-[2-[4-(dimethylamino)piperidin-1-yl]ethyl]-2-pyrrolidin-2-ylacetamide
CID 119895457
N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-2-pyrrolidin-2-ylacetamide;dihydrochloride
CID 119854841
N-(2-piperidin-1-ylethyl)-2-pyrrolidin-2-ylacetamide
CID 54967426
N-(oxan-4-ylmethyl)-2-piperidin-2-ylacetamide
CID 55226266
N-[[1-[2-(dimethylamino)ethyl]piperidin-4-yl]methyl]-3-piperidin-4-ylbutanamide;dihydrochloride
CID 119862726
N-[2-(1-methylpiperidin-4-yl)ethyl]-2-pyrrolidin-2-ylacetamide
CID 113267487
(2S,4S)-N-[[1-[2-(dimethylamino)ethyl]piperidin-4-yl]methyl]-2-methylpiperidine-4-carboxamide;dihydrochloride
CID 120645262
N-[(2,2-dimethylcyclopropyl)methyl]-2-pyrrolidin-2-ylacetamide
CID 103811357
N-[[1-[2-(dimethylamino)ethyl]piperidin-4-yl]methyl]morpholine-3-carboxamide
CID 119862675
2-pyrrolidin-2-yl-N-(3-pyrrolidin-1-ylpropyl)acetamide;dihydrochloride
CID 119835586

Frequently Asked Questions

What is the IUPAC name of N-[[1-[2-(dimethylamino)ethyl]piperidin-4-yl]methyl]-2-pyrrolidin-2-ylacetamide?
The IUPAC name of N-[[1-[2-(dimethylamino)ethyl]piperidin-4-yl]methyl]-2-pyrrolidin-2-ylacetamide (CID 119862739) is N-[[1-[2-(dimethylamino)ethyl]piperidin-4-yl]methyl]-2-pyrrolidin-2-ylacetamide.
What is the SMILES notation for N-[[1-[2-(dimethylamino)ethyl]piperidin-4-yl]methyl]-2-pyrrolidin-2-ylacetamide?
The canonical SMILES for N-[[1-[2-(dimethylamino)ethyl]piperidin-4-yl]methyl]-2-pyrrolidin-2-ylacetamide is CN(C)CCN1CCC(CNC(=O)CC2CCCN2)CC1.
What is the InChIKey of N-[[1-[2-(dimethylamino)ethyl]piperidin-4-yl]methyl]-2-pyrrolidin-2-ylacetamide?
The InChIKey is TVDSVNKINRCUAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N4O/c1-19(2)10-11-20-8-5-14(6-9-20)13-18-16(21)12-15-4-3-7-17-15/h14-15,17H,3-13H2,1-2H3,(H,18,21).
What are the key properties of N-[[1-[2-(dimethylamino)ethyl]piperidin-4-yl]methyl]-2-pyrrolidin-2-ylacetamide?
N-[[1-[2-(dimethylamino)ethyl]piperidin-4-yl]methyl]-2-pyrrolidin-2-ylacetamide has a molecular weight of 296.46 g/mol, XLogP of 0.52, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-[2-(dimethylamino)ethyl]piperidin-4-yl]methyl]-2-pyrrolidin-2-ylacetamide is sourced from PubChem (CID 119862739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).