(3-ethylcyclobutyl)carbamic acid

C7H13NO2 — CID 89387578

IUPAC(3-ethylcyclobutyl)carbamic acid
SMILESCCC1CC(NC(=O)O)C1
InChIInChI=1S/C7H13NO2/c1-2-5-3-6(4-5)8-7(9)10/h5-6,8H,2-4H2,1H3,(H,9,10)
InChIKeyUHGHVKDQQDHAFE-UHFFFAOYSA-N
MW143.19 g/mol
LogP1.44
Rot. Bonds2

About (3-ethylcyclobutyl)carbamic acid

(3-ethylcyclobutyl)carbamic acid (PubChem CID 89387578) has the molecular formula C7H13NO2 and a molecular weight of 143.19 g/mol. Its IUPAC name is (3-ethylcyclobutyl)carbamic acid.

Molecular Properties

Compound Name(3-ethylcyclobutyl)carbamic acid
PubChem CID89387578
Molecular FormulaC7H13NO2
Molecular Weight143.19 g/mol
Exact Mass143.09
IUPAC Name(3-ethylcyclobutyl)carbamic acid
SMILESCCC1CC(NC(=O)O)C1
InChIInChI=1S/C7H13NO2/c1-2-5-3-6(4-5)8-7(9)10/h5-6,8H,2-4H2,1H3,(H,9,10)
InChIKeyUHGHVKDQQDHAFE-UHFFFAOYSA-N
XLogP1.44
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (3-ethylcyclobutyl)carbamic acid?
The IUPAC name of (3-ethylcyclobutyl)carbamic acid (CID 89387578) is (3-ethylcyclobutyl)carbamic acid.
What is the SMILES notation for (3-ethylcyclobutyl)carbamic acid?
The canonical SMILES for (3-ethylcyclobutyl)carbamic acid is CCC1CC(NC(=O)O)C1.
What is the InChIKey of (3-ethylcyclobutyl)carbamic acid?
The InChIKey is UHGHVKDQQDHAFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO2/c1-2-5-3-6(4-5)8-7(9)10/h5-6,8H,2-4H2,1H3,(H,9,10).
What are the key properties of (3-ethylcyclobutyl)carbamic acid?
(3-ethylcyclobutyl)carbamic acid has a molecular weight of 143.19 g/mol, XLogP of 1.44, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethylcyclobutyl)carbamic acid is sourced from PubChem (CID 89387578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).