N-pyrrolidin-3-yloxane-4-carboxamide

C10H18N2O2 — CID 43603606

IUPACN-pyrrolidin-3-yloxane-4-carboxamide
SMILESO=C(NC1CCNC1)C1CCOCC1
InChIInChI=1S/C10H18N2O2/c13-10(8-2-5-14-6-3-8)12-9-1-4-11-7-9/h8-9,11H,1-7H2,(H,12,13)
InChIKeySZYYGCGLRJZPKU-UHFFFAOYSA-N
MW198.27 g/mol
LogP-0.11
Rot. Bonds2

About N-pyrrolidin-3-yloxane-4-carboxamide

N-pyrrolidin-3-yloxane-4-carboxamide (PubChem CID 43603606) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is N-pyrrolidin-3-yloxane-4-carboxamide.

Molecular Properties

Compound NameN-pyrrolidin-3-yloxane-4-carboxamide
PubChem CID43603606
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC NameN-pyrrolidin-3-yloxane-4-carboxamide
SMILESO=C(NC1CCNC1)C1CCOCC1
InChIInChI=1S/C10H18N2O2/c13-10(8-2-5-14-6-3-8)12-9-1-4-11-7-9/h8-9,11H,1-7H2,(H,12,13)
InChIKeySZYYGCGLRJZPKU-UHFFFAOYSA-N
XLogP-0.11
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 5-0.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-pyrrolidin-3-yloxane-4-carboxamide?
The IUPAC name of N-pyrrolidin-3-yloxane-4-carboxamide (CID 43603606) is N-pyrrolidin-3-yloxane-4-carboxamide.
What is the SMILES notation for N-pyrrolidin-3-yloxane-4-carboxamide?
The canonical SMILES for N-pyrrolidin-3-yloxane-4-carboxamide is O=C(NC1CCNC1)C1CCOCC1.
What is the InChIKey of N-pyrrolidin-3-yloxane-4-carboxamide?
The InChIKey is SZYYGCGLRJZPKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2/c13-10(8-2-5-14-6-3-8)12-9-1-4-11-7-9/h8-9,11H,1-7H2,(H,12,13).
What are the key properties of N-pyrrolidin-3-yloxane-4-carboxamide?
N-pyrrolidin-3-yloxane-4-carboxamide has a molecular weight of 198.27 g/mol, XLogP of -0.11, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyrrolidin-3-yloxane-4-carboxamide is sourced from PubChem (CID 43603606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).