(3-cyclopropyloxycyclobutyl)carbamic acid

C8H13NO3 — CID 172801977

IUPAC(3-cyclopropyloxycyclobutyl)carbamic acid
SMILESO=C(O)NC1CC(OC2CC2)C1
InChIInChI=1S/C8H13NO3/c10-8(11)9-5-3-7(4-5)12-6-1-2-6/h5-7,9H,1-4H2,(H,10,11)
InChIKeyQZIIWFQXMVCBEA-UHFFFAOYSA-N
MW171.20 g/mol
LogP0.96
Rot. Bonds3

About (3-cyclopropyloxycyclobutyl)carbamic acid

(3-cyclopropyloxycyclobutyl)carbamic acid (PubChem CID 172801977) has the molecular formula C8H13NO3 and a molecular weight of 171.20 g/mol. Its IUPAC name is (3-cyclopropyloxycyclobutyl)carbamic acid.

Molecular Properties

Compound Name(3-cyclopropyloxycyclobutyl)carbamic acid
PubChem CID172801977
Molecular FormulaC8H13NO3
Molecular Weight171.20 g/mol
Exact Mass171.09
IUPAC Name(3-cyclopropyloxycyclobutyl)carbamic acid
SMILESO=C(O)NC1CC(OC2CC2)C1
InChIInChI=1S/C8H13NO3/c10-8(11)9-5-3-7(4-5)12-6-1-2-6/h5-7,9H,1-4H2,(H,10,11)
InChIKeyQZIIWFQXMVCBEA-UHFFFAOYSA-N
XLogP0.96
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.20
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3-cyclopropyloxycyclobutyl)carbamic acid?
The IUPAC name of (3-cyclopropyloxycyclobutyl)carbamic acid (CID 172801977) is (3-cyclopropyloxycyclobutyl)carbamic acid.
What is the SMILES notation for (3-cyclopropyloxycyclobutyl)carbamic acid?
The canonical SMILES for (3-cyclopropyloxycyclobutyl)carbamic acid is O=C(O)NC1CC(OC2CC2)C1.
What is the InChIKey of (3-cyclopropyloxycyclobutyl)carbamic acid?
The InChIKey is QZIIWFQXMVCBEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO3/c10-8(11)9-5-3-7(4-5)12-6-1-2-6/h5-7,9H,1-4H2,(H,10,11).
What are the key properties of (3-cyclopropyloxycyclobutyl)carbamic acid?
(3-cyclopropyloxycyclobutyl)carbamic acid has a molecular weight of 171.20 g/mol, XLogP of 0.96, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-cyclopropyloxycyclobutyl)carbamic acid is sourced from PubChem (CID 172801977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).