methyl N-(2-piperazin-1-ylacetyl)carbamate

C8H15N3O3 — CID 43162377

IUPACmethyl N-(2-piperazin-1-ylacetyl)carbamate
SMILESCOC(=O)NC(=O)CN1CCNCC1
InChIInChI=1S/C8H15N3O3/c1-14-8(13)10-7(12)6-11-4-2-9-3-5-11/h9H,2-6H2,1H3,(H,10,12,13)
InChIKeyNWRJQGJVWBDOIA-UHFFFAOYSA-N
MW201.23 g/mol
LogP-1.23
Rot. Bonds2

About methyl N-(2-piperazin-1-ylacetyl)carbamate

methyl N-(2-piperazin-1-ylacetyl)carbamate (PubChem CID 43162377) has the molecular formula C8H15N3O3 and a molecular weight of 201.23 g/mol. Its IUPAC name is methyl N-(2-piperazin-1-ylacetyl)carbamate.

Molecular Properties

Compound Namemethyl N-(2-piperazin-1-ylacetyl)carbamate
PubChem CID43162377
Molecular FormulaC8H15N3O3
Molecular Weight201.23 g/mol
Exact Mass201.11
IUPAC Namemethyl N-(2-piperazin-1-ylacetyl)carbamate
SMILESCOC(=O)NC(=O)CN1CCNCC1
InChIInChI=1S/C8H15N3O3/c1-14-8(13)10-7(12)6-11-4-2-9-3-5-11/h9H,2-6H2,1H3,(H,10,12,13)
InChIKeyNWRJQGJVWBDOIA-UHFFFAOYSA-N
XLogP-1.23
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.23
LogP ≤ 5-1.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-acetyl-2-piperazin-1-ylacetamide
CID 67050352
N-methyl-2-[7-[2-(methylamino)-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetamide
CID 10615193
methyl N-[2-[methyl(2-piperazin-1-ylethyl)amino]acetyl]carbamate
CID 55167527
N-iodo-2-piperazin-1-ylacetamide
CID 171526171
2-[1-[2-(methoxycarbonylamino)-2-oxoethyl]piperidin-4-yl]acetic acid
CID 79605754
N-(2-methoxypropyl)-2-piperazin-1-ylacetamide;dihydrochloride
CID 69457989
N-(1-methoxy-3-methylbutan-2-yl)-2-piperazin-1-ylacetamide
CID 65049341
methyl N-[2-[methyl-(2-oxo-2-piperazin-1-ylethyl)amino]acetyl]carbamate
CID 54903931
N-(3-methylbutylcarbamoyl)-2-piperazin-1-ylacetamide
CID 43162386
methyl N-[2-(3-hydroxy-3-methylpyrrolidin-1-yl)acetyl]carbamate
CID 103728689
1-((415N)1,4-diazinan-1-yl)propan-2-one
CID 58823346
methyl N-[2-[2-(hydroxymethyl)morpholin-4-yl]acetyl]carbamate
CID 79833806

Frequently Asked Questions

What is the IUPAC name of methyl N-(2-piperazin-1-ylacetyl)carbamate?
The IUPAC name of methyl N-(2-piperazin-1-ylacetyl)carbamate (CID 43162377) is methyl N-(2-piperazin-1-ylacetyl)carbamate.
What is the SMILES notation for methyl N-(2-piperazin-1-ylacetyl)carbamate?
The canonical SMILES for methyl N-(2-piperazin-1-ylacetyl)carbamate is COC(=O)NC(=O)CN1CCNCC1.
What is the InChIKey of methyl N-(2-piperazin-1-ylacetyl)carbamate?
The InChIKey is NWRJQGJVWBDOIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O3/c1-14-8(13)10-7(12)6-11-4-2-9-3-5-11/h9H,2-6H2,1H3,(H,10,12,13).
What are the key properties of methyl N-(2-piperazin-1-ylacetyl)carbamate?
methyl N-(2-piperazin-1-ylacetyl)carbamate has a molecular weight of 201.23 g/mol, XLogP of -1.23, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-(2-piperazin-1-ylacetyl)carbamate is sourced from PubChem (CID 43162377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).