4-amino-N-ethyl-3-(4-pyridin-2-ylpiperazin-1-yl)butanamide

C15H25N5O — CID 66426934

IUPAC4-amino-N-ethyl-3-(4-pyridin-2-ylpiperazin-1-yl)butanamide
SMILESCCNC(=O)CC(CN)N1CCN(c2ccccn2)CC1
InChIInChI=1S/C15H25N5O/c1-2-17-15(21)11-13(12-16)19-7-9-20(10-8-19)14-5-3-4-6-18-14/h3-6,13H,2,7-12,16H2,1H3,(H,17,21)
InChIKeyRHTYSRLINOJXHX-UHFFFAOYSA-N
MW291.40 g/mol
LogP0.06
Rot. Bonds6

About 4-amino-N-ethyl-3-(4-pyridin-2-ylpiperazin-1-yl)butanamide

4-amino-N-ethyl-3-(4-pyridin-2-ylpiperazin-1-yl)butanamide (PubChem CID 66426934) has the molecular formula C15H25N5O and a molecular weight of 291.40 g/mol. Its IUPAC name is 4-amino-N-ethyl-3-(4-pyridin-2-ylpiperazin-1-yl)butanamide.

Molecular Properties

Compound Name4-amino-N-ethyl-3-(4-pyridin-2-ylpiperazin-1-yl)butanamide
PubChem CID66426934
Molecular FormulaC15H25N5O
Molecular Weight291.40 g/mol
Exact Mass291.21
IUPAC Name4-amino-N-ethyl-3-(4-pyridin-2-ylpiperazin-1-yl)butanamide
SMILESCCNC(=O)CC(CN)N1CCN(c2ccccn2)CC1
InChIInChI=1S/C15H25N5O/c1-2-17-15(21)11-13(12-16)19-7-9-20(10-8-19)14-5-3-4-6-18-14/h3-6,13H,2,7-12,16H2,1H3,(H,17,21)
InChIKeyRHTYSRLINOJXHX-UHFFFAOYSA-N
XLogP0.06
TPSA74.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.40
LogP ≤ 50.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-amino-N-methyl-3-(4-pyrimidin-2-ylpiperazin-1-yl)butanamide
CID 66428194
N-[2-oxo-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]propanamide
CID 47411908
N-ethyl-N-[2-(ethylamino)-2-oxoethyl]-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide
CID 8616542
2-(methylamino)-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone;hydrochloride
CID 120703285
3-(4-pyridin-2-ylpiperazin-1-yl)butan-2-ol
CID 78976730
[4-(1-aminobutan-2-yl)piperazin-1-yl]-pyridin-2-ylmethanone
CID 55201001
ethyl N-[2-oxo-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]carbamate
CID 112994654
1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one
CID 18714915
N-pentan-3-yl-4-pyridin-2-ylpiperazine-1-carboxamide
CID 47151884
4-amino-3-[4-(2-fluorophenyl)piperazin-1-yl]-N-methylbutanamide
CID 66428406
5-amino-4-methyl-N-(1-pyridin-2-ylpiperidin-4-yl)pentanamide
CID 82013435
N-(1-aminohexan-2-yl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide;dihydrochloride
CID 119665105

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-ethyl-3-(4-pyridin-2-ylpiperazin-1-yl)butanamide?
The IUPAC name of 4-amino-N-ethyl-3-(4-pyridin-2-ylpiperazin-1-yl)butanamide (CID 66426934) is 4-amino-N-ethyl-3-(4-pyridin-2-ylpiperazin-1-yl)butanamide.
What is the SMILES notation for 4-amino-N-ethyl-3-(4-pyridin-2-ylpiperazin-1-yl)butanamide?
The canonical SMILES for 4-amino-N-ethyl-3-(4-pyridin-2-ylpiperazin-1-yl)butanamide is CCNC(=O)CC(CN)N1CCN(c2ccccn2)CC1.
What is the InChIKey of 4-amino-N-ethyl-3-(4-pyridin-2-ylpiperazin-1-yl)butanamide?
The InChIKey is RHTYSRLINOJXHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5O/c1-2-17-15(21)11-13(12-16)19-7-9-20(10-8-19)14-5-3-4-6-18-14/h3-6,13H,2,7-12,16H2,1H3,(H,17,21).
What are the key properties of 4-amino-N-ethyl-3-(4-pyridin-2-ylpiperazin-1-yl)butanamide?
4-amino-N-ethyl-3-(4-pyridin-2-ylpiperazin-1-yl)butanamide has a molecular weight of 291.40 g/mol, XLogP of 0.06, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-ethyl-3-(4-pyridin-2-ylpiperazin-1-yl)butanamide is sourced from PubChem (CID 66426934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).