N-ethyl-3-hydroxypyrrolidine-1-carboxamide

C7H14N2O2 — CID 62917461

IUPACN-ethyl-3-hydroxypyrrolidine-1-carboxamide
SMILESCCNC(=O)N1CCC(O)C1
InChIInChI=1S/C7H14N2O2/c1-2-8-7(11)9-4-3-6(10)5-9/h6,10H,2-5H2,1H3,(H,8,11)
InChIKeyDVJKGRCBYRGELK-UHFFFAOYSA-N
MW158.20 g/mol
LogP-0.22
Rot. Bonds1

About N-ethyl-3-hydroxypyrrolidine-1-carboxamide

N-ethyl-3-hydroxypyrrolidine-1-carboxamide (PubChem CID 62917461) has the molecular formula C7H14N2O2 and a molecular weight of 158.20 g/mol. Its IUPAC name is N-ethyl-3-hydroxypyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-ethyl-3-hydroxypyrrolidine-1-carboxamide
PubChem CID62917461
Molecular FormulaC7H14N2O2
Molecular Weight158.20 g/mol
Exact Mass158.11
IUPAC NameN-ethyl-3-hydroxypyrrolidine-1-carboxamide
SMILESCCNC(=O)N1CCC(O)C1
InChIInChI=1S/C7H14N2O2/c1-2-8-7(11)9-4-3-6(10)5-9/h6,10H,2-5H2,1H3,(H,8,11)
InChIKeyDVJKGRCBYRGELK-UHFFFAOYSA-N
XLogP-0.22
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 5-0.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-hydroxypyrrolidine-1-carboxamide?
The IUPAC name of N-ethyl-3-hydroxypyrrolidine-1-carboxamide (CID 62917461) is N-ethyl-3-hydroxypyrrolidine-1-carboxamide.
What is the SMILES notation for N-ethyl-3-hydroxypyrrolidine-1-carboxamide?
The canonical SMILES for N-ethyl-3-hydroxypyrrolidine-1-carboxamide is CCNC(=O)N1CCC(O)C1.
What is the InChIKey of N-ethyl-3-hydroxypyrrolidine-1-carboxamide?
The InChIKey is DVJKGRCBYRGELK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O2/c1-2-8-7(11)9-4-3-6(10)5-9/h6,10H,2-5H2,1H3,(H,8,11).
What are the key properties of N-ethyl-3-hydroxypyrrolidine-1-carboxamide?
N-ethyl-3-hydroxypyrrolidine-1-carboxamide has a molecular weight of 158.20 g/mol, XLogP of -0.22, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-hydroxypyrrolidine-1-carboxamide is sourced from PubChem (CID 62917461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).