2-(4-hydroxypiperidin-1-yl)-N-[(2-piperazin-1-yl-4-pyridinyl)methyl]acetamide

C17H27N5O2 — CID 167927821

IUPAC2-(4-hydroxypiperidin-1-yl)-N-[(2-piperazin-1-yl-4-pyridinyl)methyl]acetamide
SMILESO=C(CN1CCC(O)CC1)NCc1ccnc(N2CCNCC2)c1
InChIInChI=1S/C17H27N5O2/c23-15-2-7-21(8-3-15)13-17(24)20-12-14-1-4-19-16(11-14)22-9-5-18-6-10-22/h1,4,11,15,18,23H,2-3,5-10,12-13H2,(H,20,24)
InChIKeyVHJHKFGZHRBPIN-UHFFFAOYSA-N
MW333.44 g/mol
LogP-0.44
Rot. Bonds5

About 2-(4-hydroxypiperidin-1-yl)-N-[(2-piperazin-1-yl-4-pyridinyl)methyl]acetamide

2-(4-hydroxypiperidin-1-yl)-N-[(2-piperazin-1-yl-4-pyridinyl)methyl]acetamide (PubChem CID 167927821) has the molecular formula C17H27N5O2 and a molecular weight of 333.44 g/mol. Its IUPAC name is 2-(4-hydroxypiperidin-1-yl)-N-[(2-piperazin-1-yl-4-pyridinyl)methyl]acetamide.

Molecular Properties

Compound Name2-(4-hydroxypiperidin-1-yl)-N-[(2-piperazin-1-yl-4-pyridinyl)methyl]acetamide
PubChem CID167927821
Molecular FormulaC17H27N5O2
Molecular Weight333.44 g/mol
Exact Mass333.22
IUPAC Name2-(4-hydroxypiperidin-1-yl)-N-[(2-piperazin-1-yl-4-pyridinyl)methyl]acetamide
SMILESO=C(CN1CCC(O)CC1)NCc1ccnc(N2CCNCC2)c1
InChIInChI=1S/C17H27N5O2/c23-15-2-7-21(8-3-15)13-17(24)20-12-14-1-4-19-16(11-14)22-9-5-18-6-10-22/h1,4,11,15,18,23H,2-3,5-10,12-13H2,(H,20,24)
InChIKeyVHJHKFGZHRBPIN-UHFFFAOYSA-N
XLogP-0.44
TPSA80.73 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.44
LogP ≤ 5-0.44
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(2-methoxy-4-pyridinyl)methyl]-2-piperazin-1-ylacetamide
CID 62995583
N-[[2-(4-methylpiperazin-1-yl)-4-pyridinyl]methyl]-2-pyrazol-1-ylacetamide
CID 53499617
3-amino-N-[(2-pyrrolidin-1-yl-4-pyridinyl)methyl]propanamide
CID 119841583
N-[[2-(4-methylpiperazin-1-yl)-4-pyridinyl]methyl]-2-thiomorpholin-3-ylacetamide;trihydrochloride
CID 119942599
N-[(2,3-dimethyl-1H-indol-5-yl)methyl]-2-(4-hydroxypiperidin-1-yl)acetamide
CID 26406442
2-(3-cyclopropyl-6-oxopyridazin-1-yl)-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]acetamide
CID 122278617
N-[(2-morpholin-4-yl-4-pyridinyl)methyl]butanamide
CID 32585359
5-methyl-1-piperidin-4-yl-N-[(2-pyrrolidin-1-yl-4-pyridinyl)methyl]triazole-4-carboxamide
CID 119841519
N-[[2-(4-ethylpiperazin-1-yl)-4-pyridinyl]methyl]pentanamide
CID 49172277
2-[4-[N-[[2-(azepan-1-yl)-4-pyridinyl]methyl]-N'-methylcarbamimidoyl]piperazin-1-yl]-N-cyclopropylacetamide
CID 111984993
2,7-dimethyl-N-[(2-piperazin-1-yl-4-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidine-6-carboxamide
CID 167935038
5-methyl-1-piperidin-4-yl-N-[(2-piperidin-1-yl-4-pyridinyl)methyl]triazole-4-carboxamide
CID 119841338

Frequently Asked Questions

What is the IUPAC name of 2-(4-hydroxypiperidin-1-yl)-N-[(2-piperazin-1-yl-4-pyridinyl)methyl]acetamide?
The IUPAC name of 2-(4-hydroxypiperidin-1-yl)-N-[(2-piperazin-1-yl-4-pyridinyl)methyl]acetamide (CID 167927821) is 2-(4-hydroxypiperidin-1-yl)-N-[(2-piperazin-1-yl-4-pyridinyl)methyl]acetamide.
What is the SMILES notation for 2-(4-hydroxypiperidin-1-yl)-N-[(2-piperazin-1-yl-4-pyridinyl)methyl]acetamide?
The canonical SMILES for 2-(4-hydroxypiperidin-1-yl)-N-[(2-piperazin-1-yl-4-pyridinyl)methyl]acetamide is O=C(CN1CCC(O)CC1)NCc1ccnc(N2CCNCC2)c1.
What is the InChIKey of 2-(4-hydroxypiperidin-1-yl)-N-[(2-piperazin-1-yl-4-pyridinyl)methyl]acetamide?
The InChIKey is VHJHKFGZHRBPIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N5O2/c23-15-2-7-21(8-3-15)13-17(24)20-12-14-1-4-19-16(11-14)22-9-5-18-6-10-22/h1,4,11,15,18,23H,2-3,5-10,12-13H2,(H,20,24).
What are the key properties of 2-(4-hydroxypiperidin-1-yl)-N-[(2-piperazin-1-yl-4-pyridinyl)methyl]acetamide?
2-(4-hydroxypiperidin-1-yl)-N-[(2-piperazin-1-yl-4-pyridinyl)methyl]acetamide has a molecular weight of 333.44 g/mol, XLogP of -0.44, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-hydroxypiperidin-1-yl)-N-[(2-piperazin-1-yl-4-pyridinyl)methyl]acetamide is sourced from PubChem (CID 167927821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).