N-[4-(3-hydroxypropyl)piperazin-1-yl]acetamide

C9H19N3O2 — CID 163505577

IUPACN-[4-(3-hydroxypropyl)piperazin-1-yl]acetamide
SMILESCC(=O)NN1CCN(CCCO)CC1
InChIInChI=1S/C9H19N3O2/c1-9(14)10-12-6-4-11(5-7-12)3-2-8-13/h13H,2-8H2,1H3,(H,10,14)
InChIKeyCYGZTCBDJMROTQ-UHFFFAOYSA-N
MW201.27 g/mol
LogP-0.96
Rot. Bonds4

About N-[4-(3-hydroxypropyl)piperazin-1-yl]acetamide

N-[4-(3-hydroxypropyl)piperazin-1-yl]acetamide (PubChem CID 163505577) has the molecular formula C9H19N3O2 and a molecular weight of 201.27 g/mol. Its IUPAC name is N-[4-(3-hydroxypropyl)piperazin-1-yl]acetamide.

Molecular Properties

Compound NameN-[4-(3-hydroxypropyl)piperazin-1-yl]acetamide
PubChem CID163505577
Molecular FormulaC9H19N3O2
Molecular Weight201.27 g/mol
Exact Mass201.15
IUPAC NameN-[4-(3-hydroxypropyl)piperazin-1-yl]acetamide
SMILESCC(=O)NN1CCN(CCCO)CC1
InChIInChI=1S/C9H19N3O2/c1-9(14)10-12-6-4-11(5-7-12)3-2-8-13/h13H,2-8H2,1H3,(H,10,14)
InChIKeyCYGZTCBDJMROTQ-UHFFFAOYSA-N
XLogP-0.96
TPSA55.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 5-0.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[4-(3-hydroxypropyl)piperazin-1-yl]carbamic acid
CID 54447441
N-pyrrolidin-1-ylacetamide
CID 22023174
N-(azetidin-1-yl)acetamide
CID 54074158
10-(4-methylpiperazin-1-yl)decan-1-ol;12-(4-methylpiperazin-1-yl)dodecan-1-ol
CID 22218533
4-[4-(2-methylpropyl)piperazin-1-yl]butan-1-ol
CID 62777800
4-(3-hydroxypropyl)piperazine-1-carboxamide
CID 138521354
3-[1-(3-hydroxypropyl)piperidin-4-yl]but-3-en-2-one
CID 146478395
3-[4-(3-hydroxypropyl)-1,4-diazepan-1-yl]propan-1-ol;hydrobromide
CID 70500350
methyl 3-[4-(6-hydroxyhexyl)piperazin-1-yl]propanoate
CID 113252132
methyl 3-[4-(5-hydroxypentyl)piperazin-1-yl]propanoate
CID 78918620
N-[4-(4-methylpiperazin-1-yl)butyl]acetamide
CID 110459248
1-[4-(2-hydroxyethyl)piperazin-1-yl]ethanone
CID 4739629

Frequently Asked Questions

What is the IUPAC name of N-[4-(3-hydroxypropyl)piperazin-1-yl]acetamide?
The IUPAC name of N-[4-(3-hydroxypropyl)piperazin-1-yl]acetamide (CID 163505577) is N-[4-(3-hydroxypropyl)piperazin-1-yl]acetamide.
What is the SMILES notation for N-[4-(3-hydroxypropyl)piperazin-1-yl]acetamide?
The canonical SMILES for N-[4-(3-hydroxypropyl)piperazin-1-yl]acetamide is CC(=O)NN1CCN(CCCO)CC1.
What is the InChIKey of N-[4-(3-hydroxypropyl)piperazin-1-yl]acetamide?
The InChIKey is CYGZTCBDJMROTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O2/c1-9(14)10-12-6-4-11(5-7-12)3-2-8-13/h13H,2-8H2,1H3,(H,10,14).
What are the key properties of N-[4-(3-hydroxypropyl)piperazin-1-yl]acetamide?
N-[4-(3-hydroxypropyl)piperazin-1-yl]acetamide has a molecular weight of 201.27 g/mol, XLogP of -0.96, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3-hydroxypropyl)piperazin-1-yl]acetamide is sourced from PubChem (CID 163505577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).