2-[(3-morpholin-4-yl-3-oxopropyl)amino]pyridine-3-carboxamide

C13H18N4O3 — CID 115578372

IUPAC2-[(3-morpholin-4-yl-3-oxopropyl)amino]pyridine-3-carboxamide
SMILESNC(=O)c1cccnc1NCCC(=O)N1CCOCC1
InChIInChI=1S/C13H18N4O3/c14-12(19)10-2-1-4-15-13(10)16-5-3-11(18)17-6-8-20-9-7-17/h1-2,4H,3,5-9H2,(H2,14,19)(H,15,16)
InChIKeySUBBFGLMCOVXKB-UHFFFAOYSA-N
MW278.31 g/mol
LogP-0.16
Rot. Bonds5

About 2-[(3-morpholin-4-yl-3-oxopropyl)amino]pyridine-3-carboxamide

2-[(3-morpholin-4-yl-3-oxopropyl)amino]pyridine-3-carboxamide (PubChem CID 115578372) has the molecular formula C13H18N4O3 and a molecular weight of 278.31 g/mol. Its IUPAC name is 2-[(3-morpholin-4-yl-3-oxopropyl)amino]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-[(3-morpholin-4-yl-3-oxopropyl)amino]pyridine-3-carboxamide
PubChem CID115578372
Molecular FormulaC13H18N4O3
Molecular Weight278.31 g/mol
Exact Mass278.14
IUPAC Name2-[(3-morpholin-4-yl-3-oxopropyl)amino]pyridine-3-carboxamide
SMILESNC(=O)c1cccnc1NCCC(=O)N1CCOCC1
InChIInChI=1S/C13H18N4O3/c14-12(19)10-2-1-4-15-13(10)16-5-3-11(18)17-6-8-20-9-7-17/h1-2,4H,3,5-9H2,(H2,14,19)(H,15,16)
InChIKeySUBBFGLMCOVXKB-UHFFFAOYSA-N
XLogP-0.16
TPSA97.55 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 5-0.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[(3-morpholin-4-yl-3-oxopropyl)amino]pyridine-3-carboxamide?
The IUPAC name of 2-[(3-morpholin-4-yl-3-oxopropyl)amino]pyridine-3-carboxamide (CID 115578372) is 2-[(3-morpholin-4-yl-3-oxopropyl)amino]pyridine-3-carboxamide.
What is the SMILES notation for 2-[(3-morpholin-4-yl-3-oxopropyl)amino]pyridine-3-carboxamide?
The canonical SMILES for 2-[(3-morpholin-4-yl-3-oxopropyl)amino]pyridine-3-carboxamide is NC(=O)c1cccnc1NCCC(=O)N1CCOCC1.
What is the InChIKey of 2-[(3-morpholin-4-yl-3-oxopropyl)amino]pyridine-3-carboxamide?
The InChIKey is SUBBFGLMCOVXKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O3/c14-12(19)10-2-1-4-15-13(10)16-5-3-11(18)17-6-8-20-9-7-17/h1-2,4H,3,5-9H2,(H2,14,19)(H,15,16).
What are the key properties of 2-[(3-morpholin-4-yl-3-oxopropyl)amino]pyridine-3-carboxamide?
2-[(3-morpholin-4-yl-3-oxopropyl)amino]pyridine-3-carboxamide has a molecular weight of 278.31 g/mol, XLogP of -0.16, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-morpholin-4-yl-3-oxopropyl)amino]pyridine-3-carboxamide is sourced from PubChem (CID 115578372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).