N-methylpiperazine-1-carboxamide

C6H13N3O — CID 11672770

IUPACN-methylpiperazine-1-carboxamide
SMILESCNC(=O)N1CCNCC1
InChIInChI=1S/C6H13N3O/c1-7-6(10)9-4-2-8-3-5-9/h8H,2-5H2,1H3,(H,7,10)
InChIKeyHPYONZVIPMACEZ-UHFFFAOYSA-N
MW143.19 g/mol
LogP-0.77
Rot. Bonds

About N-methylpiperazine-1-carboxamide

N-methylpiperazine-1-carboxamide (PubChem CID 11672770) has the molecular formula C6H13N3O and a molecular weight of 143.19 g/mol. Its IUPAC name is N-methylpiperazine-1-carboxamide.

Molecular Properties

Compound NameN-methylpiperazine-1-carboxamide
PubChem CID11672770
Molecular FormulaC6H13N3O
Molecular Weight143.19 g/mol
Exact Mass143.11
IUPAC NameN-methylpiperazine-1-carboxamide
SMILESCNC(=O)N1CCNCC1
InChIInChI=1S/C6H13N3O/c1-7-6(10)9-4-2-8-3-5-9/h8H,2-5H2,1H3,(H,7,10)
InChIKeyHPYONZVIPMACEZ-UHFFFAOYSA-N
XLogP-0.77
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 5-0.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methylpiperazine-1-carboxamide?
The IUPAC name of N-methylpiperazine-1-carboxamide (CID 11672770) is N-methylpiperazine-1-carboxamide.
What is the SMILES notation for N-methylpiperazine-1-carboxamide?
The canonical SMILES for N-methylpiperazine-1-carboxamide is CNC(=O)N1CCNCC1.
What is the InChIKey of N-methylpiperazine-1-carboxamide?
The InChIKey is HPYONZVIPMACEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N3O/c1-7-6(10)9-4-2-8-3-5-9/h8H,2-5H2,1H3,(H,7,10).
What are the key properties of N-methylpiperazine-1-carboxamide?
N-methylpiperazine-1-carboxamide has a molecular weight of 143.19 g/mol, XLogP of -0.77, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylpiperazine-1-carboxamide is sourced from PubChem (CID 11672770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).