4-(1,2,3,4-tetrahydroquinoline-6-carbonyl)morpholine-3-carboxamide

C15H19N3O3 — CID 83097717

IUPAC4-(1,2,3,4-tetrahydroquinoline-6-carbonyl)morpholine-3-carboxamide
SMILESNC(=O)C1COCCN1C(=O)c1ccc2c(c1)CCCN2
InChIInChI=1S/C15H19N3O3/c16-14(19)13-9-21-7-6-18(13)15(20)11-3-4-12-10(8-11)2-1-5-17-12/h3-4,8,13,17H,1-2,5-7,9H2,(H2,16,19)
InChIKeyFDECMMWREOWYPP-UHFFFAOYSA-N
MW289.33 g/mol
LogP0.37
Rot. Bonds2

About 4-(1,2,3,4-tetrahydroquinoline-6-carbonyl)morpholine-3-carboxamide

4-(1,2,3,4-tetrahydroquinoline-6-carbonyl)morpholine-3-carboxamide (PubChem CID 83097717) has the molecular formula C15H19N3O3 and a molecular weight of 289.33 g/mol. Its IUPAC name is 4-(1,2,3,4-tetrahydroquinoline-6-carbonyl)morpholine-3-carboxamide.

Molecular Properties

Compound Name4-(1,2,3,4-tetrahydroquinoline-6-carbonyl)morpholine-3-carboxamide
PubChem CID83097717
Molecular FormulaC15H19N3O3
Molecular Weight289.33 g/mol
Exact Mass289.14
IUPAC Name4-(1,2,3,4-tetrahydroquinoline-6-carbonyl)morpholine-3-carboxamide
SMILESNC(=O)C1COCCN1C(=O)c1ccc2c(c1)CCCN2
InChIInChI=1S/C15H19N3O3/c16-14(19)13-9-21-7-6-18(13)15(20)11-3-4-12-10(8-11)2-1-5-17-12/h3-4,8,13,17H,1-2,5-7,9H2,(H2,16,19)
InChIKeyFDECMMWREOWYPP-UHFFFAOYSA-N
XLogP0.37
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.33
LogP ≤ 50.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(1,2,3,4-tetrahydroquinoline-6-carbonyl)morpholine-3-carboxamide?
The IUPAC name of 4-(1,2,3,4-tetrahydroquinoline-6-carbonyl)morpholine-3-carboxamide (CID 83097717) is 4-(1,2,3,4-tetrahydroquinoline-6-carbonyl)morpholine-3-carboxamide.
What is the SMILES notation for 4-(1,2,3,4-tetrahydroquinoline-6-carbonyl)morpholine-3-carboxamide?
The canonical SMILES for 4-(1,2,3,4-tetrahydroquinoline-6-carbonyl)morpholine-3-carboxamide is NC(=O)C1COCCN1C(=O)c1ccc2c(c1)CCCN2.
What is the InChIKey of 4-(1,2,3,4-tetrahydroquinoline-6-carbonyl)morpholine-3-carboxamide?
The InChIKey is FDECMMWREOWYPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O3/c16-14(19)13-9-21-7-6-18(13)15(20)11-3-4-12-10(8-11)2-1-5-17-12/h3-4,8,13,17H,1-2,5-7,9H2,(H2,16,19).
What are the key properties of 4-(1,2,3,4-tetrahydroquinoline-6-carbonyl)morpholine-3-carboxamide?
4-(1,2,3,4-tetrahydroquinoline-6-carbonyl)morpholine-3-carboxamide has a molecular weight of 289.33 g/mol, XLogP of 0.37, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1,2,3,4-tetrahydroquinoline-6-carbonyl)morpholine-3-carboxamide is sourced from PubChem (CID 83097717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).