[3-(methylamino)cyclobutyl]carbamic acid

C6H12N2O2 — CID 90355719

IUPAC[3-(methylamino)cyclobutyl]carbamic acid
SMILESCNC1CC(NC(=O)O)C1
InChIInChI=1S/C6H12N2O2/c1-7-4-2-5(3-4)8-6(9)10/h4-5,7-8H,2-3H2,1H3,(H,9,10)
InChIKeyFSUSHDIAXNFNQG-UHFFFAOYSA-N
MW144.17 g/mol
LogP0.00
Rot. Bonds2

About [3-(methylamino)cyclobutyl]carbamic acid

[3-(methylamino)cyclobutyl]carbamic acid (PubChem CID 90355719) has the molecular formula C6H12N2O2 and a molecular weight of 144.17 g/mol. Its IUPAC name is [3-(methylamino)cyclobutyl]carbamic acid.

Molecular Properties

Compound Name[3-(methylamino)cyclobutyl]carbamic acid
PubChem CID90355719
Molecular FormulaC6H12N2O2
Molecular Weight144.17 g/mol
Exact Mass144.09
IUPAC Name[3-(methylamino)cyclobutyl]carbamic acid
SMILESCNC1CC(NC(=O)O)C1
InChIInChI=1S/C6H12N2O2/c1-7-4-2-5(3-4)8-6(9)10/h4-5,7-8H,2-3H2,1H3,(H,9,10)
InChIKeyFSUSHDIAXNFNQG-UHFFFAOYSA-N
XLogP0.00
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.17
LogP ≤ 50.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [3-(methylamino)cyclobutyl]carbamic acid?
The IUPAC name of [3-(methylamino)cyclobutyl]carbamic acid (CID 90355719) is [3-(methylamino)cyclobutyl]carbamic acid.
What is the SMILES notation for [3-(methylamino)cyclobutyl]carbamic acid?
The canonical SMILES for [3-(methylamino)cyclobutyl]carbamic acid is CNC1CC(NC(=O)O)C1.
What is the InChIKey of [3-(methylamino)cyclobutyl]carbamic acid?
The InChIKey is FSUSHDIAXNFNQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O2/c1-7-4-2-5(3-4)8-6(9)10/h4-5,7-8H,2-3H2,1H3,(H,9,10).
What are the key properties of [3-(methylamino)cyclobutyl]carbamic acid?
[3-(methylamino)cyclobutyl]carbamic acid has a molecular weight of 144.17 g/mol, XLogP of 0.00, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(methylamino)cyclobutyl]carbamic acid is sourced from PubChem (CID 90355719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).