N-[(5-fluoro-6-morpholin-4-yl-2-pyridinyl)amino]formamide

C10H13FN4O2 — CID 70954273

IUPACN-[(5-fluoro-6-morpholin-4-yl-2-pyridinyl)amino]formamide
SMILESO=CNNc1ccc(F)c(N2CCOCC2)n1
InChIInChI=1S/C10H13FN4O2/c11-8-1-2-9(14-12-7-16)13-10(8)15-3-5-17-6-4-15/h1-2,7H,3-6H2,(H,12,16)(H,13,14)
InChIKeyMDKCEHULPIHNDF-UHFFFAOYSA-N
MW240.24 g/mol
LogP0.13
Rot. Bonds4

About N-[(5-fluoro-6-morpholin-4-yl-2-pyridinyl)amino]formamide

N-[(5-fluoro-6-morpholin-4-yl-2-pyridinyl)amino]formamide (PubChem CID 70954273) has the molecular formula C10H13FN4O2 and a molecular weight of 240.24 g/mol. Its IUPAC name is N-[(5-fluoro-6-morpholin-4-yl-2-pyridinyl)amino]formamide.

Molecular Properties

Compound NameN-[(5-fluoro-6-morpholin-4-yl-2-pyridinyl)amino]formamide
PubChem CID70954273
Molecular FormulaC10H13FN4O2
Molecular Weight240.24 g/mol
Exact Mass240.10
IUPAC NameN-[(5-fluoro-6-morpholin-4-yl-2-pyridinyl)amino]formamide
SMILESO=CNNc1ccc(F)c(N2CCOCC2)n1
InChIInChI=1S/C10H13FN4O2/c11-8-1-2-9(14-12-7-16)13-10(8)15-3-5-17-6-4-15/h1-2,7H,3-6H2,(H,12,16)(H,13,14)
InChIKeyMDKCEHULPIHNDF-UHFFFAOYSA-N
XLogP0.13
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.24
LogP ≤ 50.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[(5-fluoro-6-morpholin-4-yl-2-pyridinyl)amino]formamide?
The IUPAC name of N-[(5-fluoro-6-morpholin-4-yl-2-pyridinyl)amino]formamide (CID 70954273) is N-[(5-fluoro-6-morpholin-4-yl-2-pyridinyl)amino]formamide.
What is the SMILES notation for N-[(5-fluoro-6-morpholin-4-yl-2-pyridinyl)amino]formamide?
The canonical SMILES for N-[(5-fluoro-6-morpholin-4-yl-2-pyridinyl)amino]formamide is O=CNNc1ccc(F)c(N2CCOCC2)n1.
What is the InChIKey of N-[(5-fluoro-6-morpholin-4-yl-2-pyridinyl)amino]formamide?
The InChIKey is MDKCEHULPIHNDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FN4O2/c11-8-1-2-9(14-12-7-16)13-10(8)15-3-5-17-6-4-15/h1-2,7H,3-6H2,(H,12,16)(H,13,14).
What are the key properties of N-[(5-fluoro-6-morpholin-4-yl-2-pyridinyl)amino]formamide?
N-[(5-fluoro-6-morpholin-4-yl-2-pyridinyl)amino]formamide has a molecular weight of 240.24 g/mol, XLogP of 0.13, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-fluoro-6-morpholin-4-yl-2-pyridinyl)amino]formamide is sourced from PubChem (CID 70954273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).