N-cyclopropyl-3-(1,3,5-trimethylpyrazol-4-yl)morpholine-4-carboxamide

C14H22N4O2 — CID 118740637

IUPACN-cyclopropyl-3-(1,3,5-trimethylpyrazol-4-yl)morpholine-4-carboxamide
SMILESCc1nn(C)c(C)c1C1COCCN1C(=O)NC1CC1
InChIInChI=1S/C14H22N4O2/c1-9-13(10(2)17(3)16-9)12-8-20-7-6-18(12)14(19)15-11-4-5-11/h11-12H,4-8H2,1-3H3,(H,15,19)
InChIKeyROFMBKFFPDVXFM-UHFFFAOYSA-N
MW278.36 g/mol
LogP1.28
Rot. Bonds2

About N-cyclopropyl-3-(1,3,5-trimethylpyrazol-4-yl)morpholine-4-carboxamide

N-cyclopropyl-3-(1,3,5-trimethylpyrazol-4-yl)morpholine-4-carboxamide (PubChem CID 118740637) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is N-cyclopropyl-3-(1,3,5-trimethylpyrazol-4-yl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-3-(1,3,5-trimethylpyrazol-4-yl)morpholine-4-carboxamide
PubChem CID118740637
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC NameN-cyclopropyl-3-(1,3,5-trimethylpyrazol-4-yl)morpholine-4-carboxamide
SMILESCc1nn(C)c(C)c1C1COCCN1C(=O)NC1CC1
InChIInChI=1S/C14H22N4O2/c1-9-13(10(2)17(3)16-9)12-8-20-7-6-18(12)14(19)15-11-4-5-11/h11-12H,4-8H2,1-3H3,(H,15,19)
InChIKeyROFMBKFFPDVXFM-UHFFFAOYSA-N
XLogP1.28
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-(1,3,5-trimethylpyrazol-4-yl)morpholine-4-carboxamide?
The IUPAC name of N-cyclopropyl-3-(1,3,5-trimethylpyrazol-4-yl)morpholine-4-carboxamide (CID 118740637) is N-cyclopropyl-3-(1,3,5-trimethylpyrazol-4-yl)morpholine-4-carboxamide.
What is the SMILES notation for N-cyclopropyl-3-(1,3,5-trimethylpyrazol-4-yl)morpholine-4-carboxamide?
The canonical SMILES for N-cyclopropyl-3-(1,3,5-trimethylpyrazol-4-yl)morpholine-4-carboxamide is Cc1nn(C)c(C)c1C1COCCN1C(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-3-(1,3,5-trimethylpyrazol-4-yl)morpholine-4-carboxamide?
The InChIKey is ROFMBKFFPDVXFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2/c1-9-13(10(2)17(3)16-9)12-8-20-7-6-18(12)14(19)15-11-4-5-11/h11-12H,4-8H2,1-3H3,(H,15,19).
What are the key properties of N-cyclopropyl-3-(1,3,5-trimethylpyrazol-4-yl)morpholine-4-carboxamide?
N-cyclopropyl-3-(1,3,5-trimethylpyrazol-4-yl)morpholine-4-carboxamide has a molecular weight of 278.36 g/mol, XLogP of 1.28, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-(1,3,5-trimethylpyrazol-4-yl)morpholine-4-carboxamide is sourced from PubChem (CID 118740637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).