(2-cyclopropyl-2-hydroxyethyl) carbamate

C6H11NO3 — CID 177332200

IUPAC(2-cyclopropyl-2-hydroxyethyl) carbamate
SMILESNC(=O)OCC(O)C1CC1
InChIInChI=1S/C6H11NO3/c7-6(9)10-3-5(8)4-1-2-4/h4-5,8H,1-3H2,(H2,7,9)
InChIKeyGIIDGUJRMMRRQU-UHFFFAOYSA-N
MW145.16 g/mol
LogP-0.15
Rot. Bonds3

About (2-cyclopropyl-2-hydroxyethyl) carbamate

(2-cyclopropyl-2-hydroxyethyl) carbamate (PubChem CID 177332200) has the molecular formula C6H11NO3 and a molecular weight of 145.16 g/mol. Its IUPAC name is (2-cyclopropyl-2-hydroxyethyl) carbamate.

Molecular Properties

Compound Name(2-cyclopropyl-2-hydroxyethyl) carbamate
PubChem CID177332200
Molecular FormulaC6H11NO3
Molecular Weight145.16 g/mol
Exact Mass145.07
IUPAC Name(2-cyclopropyl-2-hydroxyethyl) carbamate
SMILESNC(=O)OCC(O)C1CC1
InChIInChI=1S/C6H11NO3/c7-6(9)10-3-5(8)4-1-2-4/h4-5,8H,1-3H2,(H2,7,9)
InChIKeyGIIDGUJRMMRRQU-UHFFFAOYSA-N
XLogP-0.15
TPSA72.55 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.16
LogP ≤ 5-0.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2-cyclopropyl-2-hydroxyethyl) carbamate?
The IUPAC name of (2-cyclopropyl-2-hydroxyethyl) carbamate (CID 177332200) is (2-cyclopropyl-2-hydroxyethyl) carbamate.
What is the SMILES notation for (2-cyclopropyl-2-hydroxyethyl) carbamate?
The canonical SMILES for (2-cyclopropyl-2-hydroxyethyl) carbamate is NC(=O)OCC(O)C1CC1.
What is the InChIKey of (2-cyclopropyl-2-hydroxyethyl) carbamate?
The InChIKey is GIIDGUJRMMRRQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO3/c7-6(9)10-3-5(8)4-1-2-4/h4-5,8H,1-3H2,(H2,7,9).
What are the key properties of (2-cyclopropyl-2-hydroxyethyl) carbamate?
(2-cyclopropyl-2-hydroxyethyl) carbamate has a molecular weight of 145.16 g/mol, XLogP of -0.15, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclopropyl-2-hydroxyethyl) carbamate is sourced from PubChem (CID 177332200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).