3-cyclohexyl-2-N-morpholin-4-yl-2-N-propylpyridine-2,4-dicarboxamide

C20H30N4O3 — CID 69091571

IUPAC3-cyclohexyl-2-N-morpholin-4-yl-2-N-propylpyridine-2,4-dicarboxamide
SMILESCCCN(C(=O)c1nccc(C(N)=O)c1C1CCCCC1)N1CCOCC1
InChIInChI=1S/C20H30N4O3/c1-2-10-24(23-11-13-27-14-12-23)20(26)18-17(15-6-4-3-5-7-15)16(19(21)25)8-9-22-18/h8-9,15H,2-7,10-14H2,1H3,(H2,21,25)
InChIKeyPYRDJXNYVSMBSQ-UHFFFAOYSA-N
MW374.49 g/mol
LogP2.33
Rot. Bonds6

About 3-cyclohexyl-2-N-morpholin-4-yl-2-N-propylpyridine-2,4-dicarboxamide

3-cyclohexyl-2-N-morpholin-4-yl-2-N-propylpyridine-2,4-dicarboxamide (PubChem CID 69091571) has the molecular formula C20H30N4O3 and a molecular weight of 374.49 g/mol. Its IUPAC name is 3-cyclohexyl-2-N-morpholin-4-yl-2-N-propylpyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name3-cyclohexyl-2-N-morpholin-4-yl-2-N-propylpyridine-2,4-dicarboxamide
PubChem CID69091571
Molecular FormulaC20H30N4O3
Molecular Weight374.49 g/mol
Exact Mass374.23
IUPAC Name3-cyclohexyl-2-N-morpholin-4-yl-2-N-propylpyridine-2,4-dicarboxamide
SMILESCCCN(C(=O)c1nccc(C(N)=O)c1C1CCCCC1)N1CCOCC1
InChIInChI=1S/C20H30N4O3/c1-2-10-24(23-11-13-27-14-12-23)20(26)18-17(15-6-4-3-5-7-15)16(19(21)25)8-9-22-18/h8-9,15H,2-7,10-14H2,1H3,(H2,21,25)
InChIKeyPYRDJXNYVSMBSQ-UHFFFAOYSA-N
XLogP2.33
TPSA88.76 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.49
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-2-N-morpholin-4-yl-2-N-propylpyridine-2,4-dicarboxamide?
The IUPAC name of 3-cyclohexyl-2-N-morpholin-4-yl-2-N-propylpyridine-2,4-dicarboxamide (CID 69091571) is 3-cyclohexyl-2-N-morpholin-4-yl-2-N-propylpyridine-2,4-dicarboxamide.
What is the SMILES notation for 3-cyclohexyl-2-N-morpholin-4-yl-2-N-propylpyridine-2,4-dicarboxamide?
The canonical SMILES for 3-cyclohexyl-2-N-morpholin-4-yl-2-N-propylpyridine-2,4-dicarboxamide is CCCN(C(=O)c1nccc(C(N)=O)c1C1CCCCC1)N1CCOCC1.
What is the InChIKey of 3-cyclohexyl-2-N-morpholin-4-yl-2-N-propylpyridine-2,4-dicarboxamide?
The InChIKey is PYRDJXNYVSMBSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N4O3/c1-2-10-24(23-11-13-27-14-12-23)20(26)18-17(15-6-4-3-5-7-15)16(19(21)25)8-9-22-18/h8-9,15H,2-7,10-14H2,1H3,(H2,21,25).
What are the key properties of 3-cyclohexyl-2-N-morpholin-4-yl-2-N-propylpyridine-2,4-dicarboxamide?
3-cyclohexyl-2-N-morpholin-4-yl-2-N-propylpyridine-2,4-dicarboxamide has a molecular weight of 374.49 g/mol, XLogP of 2.33, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-2-N-morpholin-4-yl-2-N-propylpyridine-2,4-dicarboxamide is sourced from PubChem (CID 69091571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).