N-(2-morpholin-4-ylethyl)-5-phenylpyrazolidine-3-carboxamide

C16H24N4O2 — CID 74653698

IUPACN-(2-morpholin-4-ylethyl)-5-phenylpyrazolidine-3-carboxamide
SMILESO=C(NCCN1CCOCC1)C1CC(c2ccccc2)NN1
InChIInChI=1S/C16H24N4O2/c21-16(17-6-7-20-8-10-22-11-9-20)15-12-14(18-19-15)13-4-2-1-3-5-13/h1-5,14-15,18-19H,6-12H2,(H,17,21)
InChIKeyARDLAVRZBUKXPA-UHFFFAOYSA-N
MW304.39 g/mol
LogP0.04
Rot. Bonds5

About N-(2-morpholin-4-ylethyl)-5-phenylpyrazolidine-3-carboxamide

N-(2-morpholin-4-ylethyl)-5-phenylpyrazolidine-3-carboxamide (PubChem CID 74653698) has the molecular formula C16H24N4O2 and a molecular weight of 304.39 g/mol. Its IUPAC name is N-(2-morpholin-4-ylethyl)-5-phenylpyrazolidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-morpholin-4-ylethyl)-5-phenylpyrazolidine-3-carboxamide
PubChem CID74653698
Molecular FormulaC16H24N4O2
Molecular Weight304.39 g/mol
Exact Mass304.19
IUPAC NameN-(2-morpholin-4-ylethyl)-5-phenylpyrazolidine-3-carboxamide
SMILESO=C(NCCN1CCOCC1)C1CC(c2ccccc2)NN1
InChIInChI=1S/C16H24N4O2/c21-16(17-6-7-20-8-10-22-11-9-20)15-12-14(18-19-15)13-4-2-1-3-5-13/h1-5,14-15,18-19H,6-12H2,(H,17,21)
InChIKeyARDLAVRZBUKXPA-UHFFFAOYSA-N
XLogP0.04
TPSA65.63 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 50.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ylethyl)-5-phenylpyrazolidine-3-carboxamide?
The IUPAC name of N-(2-morpholin-4-ylethyl)-5-phenylpyrazolidine-3-carboxamide (CID 74653698) is N-(2-morpholin-4-ylethyl)-5-phenylpyrazolidine-3-carboxamide.
What is the SMILES notation for N-(2-morpholin-4-ylethyl)-5-phenylpyrazolidine-3-carboxamide?
The canonical SMILES for N-(2-morpholin-4-ylethyl)-5-phenylpyrazolidine-3-carboxamide is O=C(NCCN1CCOCC1)C1CC(c2ccccc2)NN1.
What is the InChIKey of N-(2-morpholin-4-ylethyl)-5-phenylpyrazolidine-3-carboxamide?
The InChIKey is ARDLAVRZBUKXPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O2/c21-16(17-6-7-20-8-10-22-11-9-20)15-12-14(18-19-15)13-4-2-1-3-5-13/h1-5,14-15,18-19H,6-12H2,(H,17,21).
What are the key properties of N-(2-morpholin-4-ylethyl)-5-phenylpyrazolidine-3-carboxamide?
N-(2-morpholin-4-ylethyl)-5-phenylpyrazolidine-3-carboxamide has a molecular weight of 304.39 g/mol, XLogP of 0.04, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylethyl)-5-phenylpyrazolidine-3-carboxamide is sourced from PubChem (CID 74653698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).