2-[4-[2-[formyl(methyl)amino]ethyl]piperazin-1-yl]acetamide

C10H20N4O2 — CID 160796876

IUPAC2-[4-[2-[formyl(methyl)amino]ethyl]piperazin-1-yl]acetamide
SMILESCN(C=O)CCN1CCN(CC(N)=O)CC1
InChIInChI=1S/C10H20N4O2/c1-12(9-15)2-3-13-4-6-14(7-5-13)8-10(11)16/h9H,2-8H2,1H3,(H2,11,16)
InChIKeySVEVRKXLXQGUFH-UHFFFAOYSA-N
MW228.30 g/mol
LogP-1.82
Rot. Bonds6

About 2-[4-[2-[formyl(methyl)amino]ethyl]piperazin-1-yl]acetamide

2-[4-[2-[formyl(methyl)amino]ethyl]piperazin-1-yl]acetamide (PubChem CID 160796876) has the molecular formula C10H20N4O2 and a molecular weight of 228.30 g/mol. Its IUPAC name is 2-[4-[2-[formyl(methyl)amino]ethyl]piperazin-1-yl]acetamide.

Molecular Properties

Compound Name2-[4-[2-[formyl(methyl)amino]ethyl]piperazin-1-yl]acetamide
PubChem CID160796876
Molecular FormulaC10H20N4O2
Molecular Weight228.30 g/mol
Exact Mass228.16
IUPAC Name2-[4-[2-[formyl(methyl)amino]ethyl]piperazin-1-yl]acetamide
SMILESCN(C=O)CCN1CCN(CC(N)=O)CC1
InChIInChI=1S/C10H20N4O2/c1-12(9-15)2-3-13-4-6-14(7-5-13)8-10(11)16/h9H,2-8H2,1H3,(H2,11,16)
InChIKeySVEVRKXLXQGUFH-UHFFFAOYSA-N
XLogP-1.82
TPSA69.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 5-1.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

2-[4-[2-[ethylamino(methyl)amino]ethyl]piperazin-1-yl]acetamide
CID 134399534
λ2-plumbane;2-[4,7,10-tris(2-amino-2-oxoethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetamide
CID 163474801
2-[7-(2-amino-2-oxoethyl)-4,10-bis(2-hydroxyethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetamide
CID 101001022
2-[4-(2-aminoethyl)-1,4-diazepan-1-yl]acetamide
CID 43252657
2-[4-(2-hydroxyethyl)-1,4-diazepan-1-yl]acetamide
CID 63309616
cis-(1S,2R)-N-[2-[4-(2-amino-2-oxoethyl)piperazin-1-yl]ethyl]-2-(2,2-dimethylpropanoyl)-N-methylcyclohexane-1-carboxamide
CID 58165960
2-(3-methylimidazolidin-1-yl)acetamide
CID 11299041
2-(azetidin-1-yl)acetamide
CID 18923030
2-[7-(2-amino-2-oxoethyl)-4-(carboxymethyl)-10-(2-hydroxyethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetic acid
CID 170255326
2-[4,7-bis(2-nitrosoethyl)-10-(2-oxopropyl)-1,4,7,10-tetrazacyclododec-1-yl]acetamide
CID 177035942
2-[4-(2-amino-2-oxoethyl)-7-(carboxymethyl)-10-(2-oxoethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetic acid;methanol
CID 171508227
2-[4-(2,2-dimethylpropyl)piperazin-1-yl]acetamide
CID 164740078

Frequently Asked Questions

What is the IUPAC name of 2-[4-[2-[formyl(methyl)amino]ethyl]piperazin-1-yl]acetamide?
The IUPAC name of 2-[4-[2-[formyl(methyl)amino]ethyl]piperazin-1-yl]acetamide (CID 160796876) is 2-[4-[2-[formyl(methyl)amino]ethyl]piperazin-1-yl]acetamide.
What is the SMILES notation for 2-[4-[2-[formyl(methyl)amino]ethyl]piperazin-1-yl]acetamide?
The canonical SMILES for 2-[4-[2-[formyl(methyl)amino]ethyl]piperazin-1-yl]acetamide is CN(C=O)CCN1CCN(CC(N)=O)CC1.
What is the InChIKey of 2-[4-[2-[formyl(methyl)amino]ethyl]piperazin-1-yl]acetamide?
The InChIKey is SVEVRKXLXQGUFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N4O2/c1-12(9-15)2-3-13-4-6-14(7-5-13)8-10(11)16/h9H,2-8H2,1H3,(H2,11,16).
What are the key properties of 2-[4-[2-[formyl(methyl)amino]ethyl]piperazin-1-yl]acetamide?
2-[4-[2-[formyl(methyl)amino]ethyl]piperazin-1-yl]acetamide has a molecular weight of 228.30 g/mol, XLogP of -1.82, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[2-[formyl(methyl)amino]ethyl]piperazin-1-yl]acetamide is sourced from PubChem (CID 160796876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).