2,2,6,6-tetramethyl-N-[2-(2-methylpyrazol-3-yl)ethyl]morpholine-4-carboxamide

C15H26N4O2 — CID 99825378

IUPAC2,2,6,6-tetramethyl-N-[2-(2-methylpyrazol-3-yl)ethyl]morpholine-4-carboxamide
SMILESCn1nccc1CCNC(=O)N1CC(C)(C)OC(C)(C)C1
InChIInChI=1S/C15H26N4O2/c1-14(2)10-19(11-15(3,4)21-14)13(20)16-8-6-12-7-9-17-18(12)5/h7,9H,6,8,10-11H2,1-5H3,(H,16,20)
InChIKeyCNIINBNHHIABQI-UHFFFAOYSA-N
MW294.40 g/mol
LogP1.56
Rot. Bonds3

About 2,2,6,6-tetramethyl-N-[2-(2-methylpyrazol-3-yl)ethyl]morpholine-4-carboxamide

2,2,6,6-tetramethyl-N-[2-(2-methylpyrazol-3-yl)ethyl]morpholine-4-carboxamide (PubChem CID 99825378) has the molecular formula C15H26N4O2 and a molecular weight of 294.40 g/mol. Its IUPAC name is 2,2,6,6-tetramethyl-N-[2-(2-methylpyrazol-3-yl)ethyl]morpholine-4-carboxamide.

Molecular Properties

Compound Name2,2,6,6-tetramethyl-N-[2-(2-methylpyrazol-3-yl)ethyl]morpholine-4-carboxamide
PubChem CID99825378
Molecular FormulaC15H26N4O2
Molecular Weight294.40 g/mol
Exact Mass294.21
IUPAC Name2,2,6,6-tetramethyl-N-[2-(2-methylpyrazol-3-yl)ethyl]morpholine-4-carboxamide
SMILESCn1nccc1CCNC(=O)N1CC(C)(C)OC(C)(C)C1
InChIInChI=1S/C15H26N4O2/c1-14(2)10-19(11-15(3,4)21-14)13(20)16-8-6-12-7-9-17-18(12)5/h7,9H,6,8,10-11H2,1-5H3,(H,16,20)
InChIKeyCNIINBNHHIABQI-UHFFFAOYSA-N
XLogP1.56
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,2,6,6-tetramethyl-N-[2-(2-methylpyrazol-3-yl)ethyl]morpholine-4-carboxamide?
The IUPAC name of 2,2,6,6-tetramethyl-N-[2-(2-methylpyrazol-3-yl)ethyl]morpholine-4-carboxamide (CID 99825378) is 2,2,6,6-tetramethyl-N-[2-(2-methylpyrazol-3-yl)ethyl]morpholine-4-carboxamide.
What is the SMILES notation for 2,2,6,6-tetramethyl-N-[2-(2-methylpyrazol-3-yl)ethyl]morpholine-4-carboxamide?
The canonical SMILES for 2,2,6,6-tetramethyl-N-[2-(2-methylpyrazol-3-yl)ethyl]morpholine-4-carboxamide is Cn1nccc1CCNC(=O)N1CC(C)(C)OC(C)(C)C1.
What is the InChIKey of 2,2,6,6-tetramethyl-N-[2-(2-methylpyrazol-3-yl)ethyl]morpholine-4-carboxamide?
The InChIKey is CNIINBNHHIABQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O2/c1-14(2)10-19(11-15(3,4)21-14)13(20)16-8-6-12-7-9-17-18(12)5/h7,9H,6,8,10-11H2,1-5H3,(H,16,20).
What are the key properties of 2,2,6,6-tetramethyl-N-[2-(2-methylpyrazol-3-yl)ethyl]morpholine-4-carboxamide?
2,2,6,6-tetramethyl-N-[2-(2-methylpyrazol-3-yl)ethyl]morpholine-4-carboxamide has a molecular weight of 294.40 g/mol, XLogP of 1.56, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,6,6-tetramethyl-N-[2-(2-methylpyrazol-3-yl)ethyl]morpholine-4-carboxamide is sourced from PubChem (CID 99825378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).