4-(aminomethyl)piperazine-1-carboxamide

C6H14N4O — CID 22006108

IUPAC4-(aminomethyl)piperazine-1-carboxamide
SMILESNCN1CCN(C(N)=O)CC1
InChIInChI=1S/C6H14N4O/c7-5-9-1-3-10(4-2-9)6(8)11/h1-5,7H2,(H2,8,11)
InChIKeyDBWUPORNRFBGPG-UHFFFAOYSA-N
MW158.20 g/mol
LogP-1.40
Rot. Bonds1

About 4-(aminomethyl)piperazine-1-carboxamide

4-(aminomethyl)piperazine-1-carboxamide (PubChem CID 22006108) has the molecular formula C6H14N4O and a molecular weight of 158.20 g/mol. Its IUPAC name is 4-(aminomethyl)piperazine-1-carboxamide.

Molecular Properties

Compound Name4-(aminomethyl)piperazine-1-carboxamide
PubChem CID22006108
Molecular FormulaC6H14N4O
Molecular Weight158.20 g/mol
Exact Mass158.12
IUPAC Name4-(aminomethyl)piperazine-1-carboxamide
SMILESNCN1CCN(C(N)=O)CC1
InChIInChI=1S/C6H14N4O/c7-5-9-1-3-10(4-2-9)6(8)11/h1-5,7H2,(H2,8,11)
InChIKeyDBWUPORNRFBGPG-UHFFFAOYSA-N
XLogP-1.40
TPSA75.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 5-1.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-propylpiperazine-1-carboxamide
CID 16792615
4-(2-chloroethyl)piperazine-1-carboxamide
CID 2757510
4-(3-hydroxypropyl)piperazine-1-carboxamide
CID 138521354
4-(3-aminopropanoyl)piperazine-1-carboxamide
CID 2756537
[4-(aminomethyl)piperazin-1-yl]methanamine;methane
CID 159106814
aziridine;aziridine-1-carboxamide
CID 157196797
4-nonylpiperazine-1-carboxamide
CID 13213299
ethyl 4-carbamoylpiperazine-1-carboxylate
CID 82076471
tert-butyl 2-(4-carbamoylpiperazin-1-yl)acetate
CID 11195897
ethane;pyrrolidine-1-carboxamide
CID 144643607
lithium;hydride;pyrrolidine-1-carboxamide
CID 173065228
ethane;piperidine-1-carboxamide
CID 176963561

Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)piperazine-1-carboxamide?
The IUPAC name of 4-(aminomethyl)piperazine-1-carboxamide (CID 22006108) is 4-(aminomethyl)piperazine-1-carboxamide.
What is the SMILES notation for 4-(aminomethyl)piperazine-1-carboxamide?
The canonical SMILES for 4-(aminomethyl)piperazine-1-carboxamide is NCN1CCN(C(N)=O)CC1.
What is the InChIKey of 4-(aminomethyl)piperazine-1-carboxamide?
The InChIKey is DBWUPORNRFBGPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N4O/c7-5-9-1-3-10(4-2-9)6(8)11/h1-5,7H2,(H2,8,11).
What are the key properties of 4-(aminomethyl)piperazine-1-carboxamide?
4-(aminomethyl)piperazine-1-carboxamide has a molecular weight of 158.20 g/mol, XLogP of -1.40, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)piperazine-1-carboxamide is sourced from PubChem (CID 22006108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).