2-hydroxyethyl N-[(1-cyclopropylpyrrolidin-3-yl)methyl]carbamate

C11H20N2O3 — CID 79348875

IUPAC2-hydroxyethyl N-[(1-cyclopropylpyrrolidin-3-yl)methyl]carbamate
SMILESO=C(NCC1CCN(C2CC2)C1)OCCO
InChIInChI=1S/C11H20N2O3/c14-5-6-16-11(15)12-7-9-3-4-13(8-9)10-1-2-10/h9-10,14H,1-8H2,(H,12,15)
InChIKeyFKYCFNPWRGUJJB-UHFFFAOYSA-N
MW228.29 g/mol
LogP0.19
Rot. Bonds5

About 2-hydroxyethyl N-[(1-cyclopropylpyrrolidin-3-yl)methyl]carbamate

2-hydroxyethyl N-[(1-cyclopropylpyrrolidin-3-yl)methyl]carbamate (PubChem CID 79348875) has the molecular formula C11H20N2O3 and a molecular weight of 228.29 g/mol. Its IUPAC name is 2-hydroxyethyl N-[(1-cyclopropylpyrrolidin-3-yl)methyl]carbamate.

Molecular Properties

Compound Name2-hydroxyethyl N-[(1-cyclopropylpyrrolidin-3-yl)methyl]carbamate
PubChem CID79348875
Molecular FormulaC11H20N2O3
Molecular Weight228.29 g/mol
Exact Mass228.15
IUPAC Name2-hydroxyethyl N-[(1-cyclopropylpyrrolidin-3-yl)methyl]carbamate
SMILESO=C(NCC1CCN(C2CC2)C1)OCCO
InChIInChI=1S/C11H20N2O3/c14-5-6-16-11(15)12-7-9-3-4-13(8-9)10-1-2-10/h9-10,14H,1-8H2,(H,12,15)
InChIKeyFKYCFNPWRGUJJB-UHFFFAOYSA-N
XLogP0.19
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 50.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxyethyl N-[(1-cyclopropylpyrrolidin-3-yl)methyl]carbamate?
The IUPAC name of 2-hydroxyethyl N-[(1-cyclopropylpyrrolidin-3-yl)methyl]carbamate (CID 79348875) is 2-hydroxyethyl N-[(1-cyclopropylpyrrolidin-3-yl)methyl]carbamate.
What is the SMILES notation for 2-hydroxyethyl N-[(1-cyclopropylpyrrolidin-3-yl)methyl]carbamate?
The canonical SMILES for 2-hydroxyethyl N-[(1-cyclopropylpyrrolidin-3-yl)methyl]carbamate is O=C(NCC1CCN(C2CC2)C1)OCCO.
What is the InChIKey of 2-hydroxyethyl N-[(1-cyclopropylpyrrolidin-3-yl)methyl]carbamate?
The InChIKey is FKYCFNPWRGUJJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3/c14-5-6-16-11(15)12-7-9-3-4-13(8-9)10-1-2-10/h9-10,14H,1-8H2,(H,12,15).
What are the key properties of 2-hydroxyethyl N-[(1-cyclopropylpyrrolidin-3-yl)methyl]carbamate?
2-hydroxyethyl N-[(1-cyclopropylpyrrolidin-3-yl)methyl]carbamate has a molecular weight of 228.29 g/mol, XLogP of 0.19, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxyethyl N-[(1-cyclopropylpyrrolidin-3-yl)methyl]carbamate is sourced from PubChem (CID 79348875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).