N-pyridin-3-yl-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide

C16H19N5O — CID 155568867

IUPACN-pyridin-3-yl-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide
SMILESO=C(CN1CCN(c2ccccn2)CC1)Nc1cccnc1
InChIInChI=1S/C16H19N5O/c22-16(19-14-4-3-6-17-12-14)13-20-8-10-21(11-9-20)15-5-1-2-7-18-15/h1-7,12H,8-11,13H2,(H,19,22)
InChIKeyMVUXSAGLLJPWRN-UHFFFAOYSA-N
MW297.36 g/mol
LogP1.24
Rot. Bonds4

About N-pyridin-3-yl-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide

N-pyridin-3-yl-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide (PubChem CID 155568867) has the molecular formula C16H19N5O and a molecular weight of 297.36 g/mol. Its IUPAC name is N-pyridin-3-yl-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide.

Molecular Properties

Compound NameN-pyridin-3-yl-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide
PubChem CID155568867
Molecular FormulaC16H19N5O
Molecular Weight297.36 g/mol
Exact Mass297.16
IUPAC NameN-pyridin-3-yl-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide
SMILESO=C(CN1CCN(c2ccccn2)CC1)Nc1cccnc1
InChIInChI=1S/C16H19N5O/c22-16(19-14-4-3-6-17-12-14)13-20-8-10-21(11-9-20)15-5-1-2-7-18-15/h1-7,12H,8-11,13H2,(H,19,22)
InChIKeyMVUXSAGLLJPWRN-UHFFFAOYSA-N
XLogP1.24
TPSA61.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

Propiram
CID 26216
Jnj-17203212
CID 11339118
N-(2,4-Difluorophenyl)-4-(2-pyridinyl)-1-piperazineacetamide
CID 3547487
Pyrido(2,3-b)pyrazine-2,3-diol
CID 74947
N,N'-Bis(2-pyridyl)oxalamide
CID 1927420
N-(2-pyridinyl)-N'-(3-pyridinyl)thiourea
CID 2766576
8-cyclopropyl-2-{[5-(piperazin-1-yl)pyridin-2-yl]amino}-7H,8H-pyrido[2,3-d]pyrimidin-7-one
CID 5330260
Pyrido-[2,3-d]-pyrimidin-7-one 20
CID 5330262
8-cyclohexyl-2-{[5-(piperazin-1-yl)pyridin-2-yl]amino}-7H,8H-pyrido[2,3-d]pyrimidin-7-one
CID 5330263
8-cyclopentyl-6-fluoro-2-{[5-(piperazin-1-yl)pyridin-2-yl]amino}-7H,8H-pyrido[2,3-d]pyrimidin-7-one
CID 5330265
Pyrido-[2,3-d]-pyrimidin-7-one 23
CID 5330266
8-cyclopentyl-6-methyl-2-{[5-(piperazin-1-yl)pyridin-2-yl]amino}-7H,8H-pyrido[2,3-d]pyrimidin-7-one
CID 5330267

Frequently Asked Questions

What is the IUPAC name of N-pyridin-3-yl-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide?
The IUPAC name of N-pyridin-3-yl-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide (CID 155568867) is N-pyridin-3-yl-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide.
What is the SMILES notation for N-pyridin-3-yl-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide?
The canonical SMILES for N-pyridin-3-yl-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide is O=C(CN1CCN(c2ccccn2)CC1)Nc1cccnc1.
What is the InChIKey of N-pyridin-3-yl-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide?
The InChIKey is MVUXSAGLLJPWRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N5O/c22-16(19-14-4-3-6-17-12-14)13-20-8-10-21(11-9-20)15-5-1-2-7-18-15/h1-7,12H,8-11,13H2,(H,19,22).
What are the key properties of N-pyridin-3-yl-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide?
N-pyridin-3-yl-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide has a molecular weight of 297.36 g/mol, XLogP of 1.24, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyridin-3-yl-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide is sourced from PubChem (CID 155568867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).