N-[2-[ethyl(methyl)amino]ethyl]-5-methylpiperazine-2-carboxamide

C11H24N4O — CID 63102583

IUPACN-[2-[ethyl(methyl)amino]ethyl]-5-methylpiperazine-2-carboxamide
SMILESCCN(C)CCNC(=O)C1CNC(C)CN1
InChIInChI=1S/C11H24N4O/c1-4-15(3)6-5-12-11(16)10-8-13-9(2)7-14-10/h9-10,13-14H,4-8H2,1-3H3,(H,12,16)
InChIKeyCLHPMGJPEPEQEK-UHFFFAOYSA-N
MW228.34 g/mol
LogP-1.00
Rot. Bonds5

About N-[2-[ethyl(methyl)amino]ethyl]-5-methylpiperazine-2-carboxamide

N-[2-[ethyl(methyl)amino]ethyl]-5-methylpiperazine-2-carboxamide (PubChem CID 63102583) has the molecular formula C11H24N4O and a molecular weight of 228.34 g/mol. Its IUPAC name is N-[2-[ethyl(methyl)amino]ethyl]-5-methylpiperazine-2-carboxamide.

Molecular Properties

Compound NameN-[2-[ethyl(methyl)amino]ethyl]-5-methylpiperazine-2-carboxamide
PubChem CID63102583
Molecular FormulaC11H24N4O
Molecular Weight228.34 g/mol
Exact Mass228.20
IUPAC NameN-[2-[ethyl(methyl)amino]ethyl]-5-methylpiperazine-2-carboxamide
SMILESCCN(C)CCNC(=O)C1CNC(C)CN1
InChIInChI=1S/C11H24N4O/c1-4-15(3)6-5-12-11(16)10-8-13-9(2)7-14-10/h9-10,13-14H,4-8H2,1-3H3,(H,12,16)
InChIKeyCLHPMGJPEPEQEK-UHFFFAOYSA-N
XLogP-1.00
TPSA56.40 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 5-1.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-[ethyl(methyl)amino]ethyl]-5-methylpiperazine-2-carboxamide?
The IUPAC name of N-[2-[ethyl(methyl)amino]ethyl]-5-methylpiperazine-2-carboxamide (CID 63102583) is N-[2-[ethyl(methyl)amino]ethyl]-5-methylpiperazine-2-carboxamide.
What is the SMILES notation for N-[2-[ethyl(methyl)amino]ethyl]-5-methylpiperazine-2-carboxamide?
The canonical SMILES for N-[2-[ethyl(methyl)amino]ethyl]-5-methylpiperazine-2-carboxamide is CCN(C)CCNC(=O)C1CNC(C)CN1.
What is the InChIKey of N-[2-[ethyl(methyl)amino]ethyl]-5-methylpiperazine-2-carboxamide?
The InChIKey is CLHPMGJPEPEQEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N4O/c1-4-15(3)6-5-12-11(16)10-8-13-9(2)7-14-10/h9-10,13-14H,4-8H2,1-3H3,(H,12,16).
What are the key properties of N-[2-[ethyl(methyl)amino]ethyl]-5-methylpiperazine-2-carboxamide?
N-[2-[ethyl(methyl)amino]ethyl]-5-methylpiperazine-2-carboxamide has a molecular weight of 228.34 g/mol, XLogP of -1.00, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[ethyl(methyl)amino]ethyl]-5-methylpiperazine-2-carboxamide is sourced from PubChem (CID 63102583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).