3-ethyl-2-morpholin-4-yl-N-[(1-propylpyrrol-3-yl)methyl]pentanamide

C19H33N3O2 — CID 119035606

IUPAC3-ethyl-2-morpholin-4-yl-N-[(1-propylpyrrol-3-yl)methyl]pentanamide
SMILESCCCn1ccc(CNC(=O)C(C(CC)CC)N2CCOCC2)c1
InChIInChI=1S/C19H33N3O2/c1-4-8-21-9-7-16(15-21)14-20-19(23)18(17(5-2)6-3)22-10-12-24-13-11-22/h7,9,15,17-18H,4-6,8,10-14H2,1-3H3,(H,20,23)
InChIKeyWQZRGZKXDSGLQA-UHFFFAOYSA-N
MW335.49 g/mol
LogP2.65
Rot. Bonds9

About 3-ethyl-2-morpholin-4-yl-N-[(1-propylpyrrol-3-yl)methyl]pentanamide

3-ethyl-2-morpholin-4-yl-N-[(1-propylpyrrol-3-yl)methyl]pentanamide (PubChem CID 119035606) has the molecular formula C19H33N3O2 and a molecular weight of 335.49 g/mol. Its IUPAC name is 3-ethyl-2-morpholin-4-yl-N-[(1-propylpyrrol-3-yl)methyl]pentanamide.

Molecular Properties

Compound Name3-ethyl-2-morpholin-4-yl-N-[(1-propylpyrrol-3-yl)methyl]pentanamide
PubChem CID119035606
Molecular FormulaC19H33N3O2
Molecular Weight335.49 g/mol
Exact Mass335.26
IUPAC Name3-ethyl-2-morpholin-4-yl-N-[(1-propylpyrrol-3-yl)methyl]pentanamide
SMILESCCCn1ccc(CNC(=O)C(C(CC)CC)N2CCOCC2)c1
InChIInChI=1S/C19H33N3O2/c1-4-8-21-9-7-16(15-21)14-20-19(23)18(17(5-2)6-3)22-10-12-24-13-11-22/h7,9,15,17-18H,4-6,8,10-14H2,1-3H3,(H,20,23)
InChIKeyWQZRGZKXDSGLQA-UHFFFAOYSA-N
XLogP2.65
TPSA46.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.49
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-2-morpholin-4-yl-N-[(1-propylpyrrol-3-yl)methyl]pentanamide?
The IUPAC name of 3-ethyl-2-morpholin-4-yl-N-[(1-propylpyrrol-3-yl)methyl]pentanamide (CID 119035606) is 3-ethyl-2-morpholin-4-yl-N-[(1-propylpyrrol-3-yl)methyl]pentanamide.
What is the SMILES notation for 3-ethyl-2-morpholin-4-yl-N-[(1-propylpyrrol-3-yl)methyl]pentanamide?
The canonical SMILES for 3-ethyl-2-morpholin-4-yl-N-[(1-propylpyrrol-3-yl)methyl]pentanamide is CCCn1ccc(CNC(=O)C(C(CC)CC)N2CCOCC2)c1.
What is the InChIKey of 3-ethyl-2-morpholin-4-yl-N-[(1-propylpyrrol-3-yl)methyl]pentanamide?
The InChIKey is WQZRGZKXDSGLQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H33N3O2/c1-4-8-21-9-7-16(15-21)14-20-19(23)18(17(5-2)6-3)22-10-12-24-13-11-22/h7,9,15,17-18H,4-6,8,10-14H2,1-3H3,(H,20,23).
What are the key properties of 3-ethyl-2-morpholin-4-yl-N-[(1-propylpyrrol-3-yl)methyl]pentanamide?
3-ethyl-2-morpholin-4-yl-N-[(1-propylpyrrol-3-yl)methyl]pentanamide has a molecular weight of 335.49 g/mol, XLogP of 2.65, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-2-morpholin-4-yl-N-[(1-propylpyrrol-3-yl)methyl]pentanamide is sourced from PubChem (CID 119035606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).