N-[2-(dimethylamino)-3-pyridinyl]-2-piperazin-1-ylacetamide

C13H21N5O — CID 60850191

IUPACN-[2-(dimethylamino)-3-pyridinyl]-2-piperazin-1-ylacetamide
SMILESCN(C)c1ncccc1NC(=O)CN1CCNCC1
InChIInChI=1S/C13H21N5O/c1-17(2)13-11(4-3-5-15-13)16-12(19)10-18-8-6-14-7-9-18/h3-5,14H,6-10H2,1-2H3,(H,16,19)
InChIKeyZOHKYXKCVDOMIK-UHFFFAOYSA-N
MW263.34 g/mol
LogP-0.01
Rot. Bonds4

About N-[2-(dimethylamino)-3-pyridinyl]-2-piperazin-1-ylacetamide

N-[2-(dimethylamino)-3-pyridinyl]-2-piperazin-1-ylacetamide (PubChem CID 60850191) has the molecular formula C13H21N5O and a molecular weight of 263.34 g/mol. Its IUPAC name is N-[2-(dimethylamino)-3-pyridinyl]-2-piperazin-1-ylacetamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-3-pyridinyl]-2-piperazin-1-ylacetamide
PubChem CID60850191
Molecular FormulaC13H21N5O
Molecular Weight263.34 g/mol
Exact Mass263.17
IUPAC NameN-[2-(dimethylamino)-3-pyridinyl]-2-piperazin-1-ylacetamide
SMILESCN(C)c1ncccc1NC(=O)CN1CCNCC1
InChIInChI=1S/C13H21N5O/c1-17(2)13-11(4-3-5-15-13)16-12(19)10-18-8-6-14-7-9-18/h3-5,14H,6-10H2,1-2H3,(H,16,19)
InChIKeyZOHKYXKCVDOMIK-UHFFFAOYSA-N
XLogP-0.01
TPSA60.50 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 5-0.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

ethane;N-(2-methylphenyl)-2-piperazin-1-ylacetamide
CID 142082017
2-[2-[[2-(dimethylamino)-3-pyridinyl]amino]-2-oxoethyl]sulfanylacetic acid
CID 104569324
4-chloro-N-[2-(dimethylamino)-3-pyridinyl]butanamide
CID 63308102
3-(tert-butylamino)-N-[2-(dimethylamino)-3-pyridinyl]propanamide
CID 60849579
N-[3-(dimethylamino)phenyl]-2-piperazin-1-ylacetamide
CID 115377065
N-[2-(dimethylamino)-3-pyridinyl]-5-hydroxypentanamide
CID 79199831
N-(2-ethylsulfonylphenyl)-2-piperazin-1-ylacetamide
CID 60850903
2-piperazin-1-yl-N-pyridin-3-ylacetamide;hydrochloride
CID 156595313
N-(2,1,3-benzoselenadiazol-4-yl)-2-piperazin-1-ylacetamide
CID 54928472
2-[[2-(1,4-diazepan-1-yl)acetyl]amino]benzoic acid
CID 62838706
6-amino-N-[2-(dimethylamino)-3-pyridinyl]hexanamide
CID 43706742
methyl 2-methyl-3-[(2-piperazin-1-ylacetyl)amino]benzoate
CID 60850740

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-3-pyridinyl]-2-piperazin-1-ylacetamide?
The IUPAC name of N-[2-(dimethylamino)-3-pyridinyl]-2-piperazin-1-ylacetamide (CID 60850191) is N-[2-(dimethylamino)-3-pyridinyl]-2-piperazin-1-ylacetamide.
What is the SMILES notation for N-[2-(dimethylamino)-3-pyridinyl]-2-piperazin-1-ylacetamide?
The canonical SMILES for N-[2-(dimethylamino)-3-pyridinyl]-2-piperazin-1-ylacetamide is CN(C)c1ncccc1NC(=O)CN1CCNCC1.
What is the InChIKey of N-[2-(dimethylamino)-3-pyridinyl]-2-piperazin-1-ylacetamide?
The InChIKey is ZOHKYXKCVDOMIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5O/c1-17(2)13-11(4-3-5-15-13)16-12(19)10-18-8-6-14-7-9-18/h3-5,14H,6-10H2,1-2H3,(H,16,19).
What are the key properties of N-[2-(dimethylamino)-3-pyridinyl]-2-piperazin-1-ylacetamide?
N-[2-(dimethylamino)-3-pyridinyl]-2-piperazin-1-ylacetamide has a molecular weight of 263.34 g/mol, XLogP of -0.01, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-3-pyridinyl]-2-piperazin-1-ylacetamide is sourced from PubChem (CID 60850191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).