6-chloro-N-(5-pyrimidin-5-yloxy-3-pyridinyl)pyridine-2-carboxamide

C15H10ClN5O2 — CID 58349107

IUPAC6-chloro-N-(5-pyrimidin-5-yloxy-3-pyridinyl)pyridine-2-carboxamide
SMILESO=C(Nc1cncc(Oc2cncnc2)c1)c1cccc(Cl)n1
InChIInChI=1S/C15H10ClN5O2/c16-14-3-1-2-13(21-14)15(22)20-10-4-11(6-17-5-10)23-12-7-18-9-19-8-12/h1-9H,(H,20,22)
InChIKeyZWGMNPNWKHDEGF-UHFFFAOYSA-N
MW327.73 g/mol
LogP2.96
Rot. Bonds4

About 6-chloro-N-(5-pyrimidin-5-yloxy-3-pyridinyl)pyridine-2-carboxamide

6-chloro-N-(5-pyrimidin-5-yloxy-3-pyridinyl)pyridine-2-carboxamide (PubChem CID 58349107) has the molecular formula C15H10ClN5O2 and a molecular weight of 327.73 g/mol. Its IUPAC name is 6-chloro-N-(5-pyrimidin-5-yloxy-3-pyridinyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-chloro-N-(5-pyrimidin-5-yloxy-3-pyridinyl)pyridine-2-carboxamide
PubChem CID58349107
Molecular FormulaC15H10ClN5O2
Molecular Weight327.73 g/mol
Exact Mass327.05
IUPAC Name6-chloro-N-(5-pyrimidin-5-yloxy-3-pyridinyl)pyridine-2-carboxamide
SMILESO=C(Nc1cncc(Oc2cncnc2)c1)c1cccc(Cl)n1
InChIInChI=1S/C15H10ClN5O2/c16-14-3-1-2-13(21-14)15(22)20-10-4-11(6-17-5-10)23-12-7-18-9-19-8-12/h1-9H,(H,20,22)
InChIKeyZWGMNPNWKHDEGF-UHFFFAOYSA-N
XLogP2.96
TPSA89.89 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.73
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

5-chloro-N-(5-pyrimidin-5-yloxy-3-pyridinyl)pyridine-3-carboxamide
CID 58349126
3-cyano-N-(5-pyrimidin-5-yloxy-3-pyridinyl)benzamide
CID 58349136
5-methyl-N-(5-pyrimidin-5-yloxy-3-pyridinyl)pyridine-3-carboxamide
CID 58349141
6-chloro-N-(3-hydroxy-4-methoxyphenyl)pyridine-2-carboxamide
CID 62234559
6-chloro-N-(3-iodophenyl)pyridine-2-carboxamide
CID 55052347
N-[3-(carbamoylamino)phenyl]-6-chloropyridine-2-carboxamide
CID 62234924
6-chloro-N-(3-ethynylphenyl)pyridine-2-carboxamide
CID 62233805
6-chloro-N-[4-(1,3-oxazol-5-yl)phenyl]pyridine-2-carboxamide
CID 62233090
6-chloro-N-[4-(1H-imidazol-5-yl)phenyl]pyridine-2-carboxamide
CID 62232925
2-[3-[(6-chloropyridine-2-carbonyl)amino]phenyl]acetic acid
CID 65345876
6-chloro-N-propan-2-ylpyridine-2-carboxamide
CID 24903389
methyl 5-[(6-chloropyridine-2-carbonyl)amino]-2-fluorobenzoate
CID 62235265

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(5-pyrimidin-5-yloxy-3-pyridinyl)pyridine-2-carboxamide?
The IUPAC name of 6-chloro-N-(5-pyrimidin-5-yloxy-3-pyridinyl)pyridine-2-carboxamide (CID 58349107) is 6-chloro-N-(5-pyrimidin-5-yloxy-3-pyridinyl)pyridine-2-carboxamide.
What is the SMILES notation for 6-chloro-N-(5-pyrimidin-5-yloxy-3-pyridinyl)pyridine-2-carboxamide?
The canonical SMILES for 6-chloro-N-(5-pyrimidin-5-yloxy-3-pyridinyl)pyridine-2-carboxamide is O=C(Nc1cncc(Oc2cncnc2)c1)c1cccc(Cl)n1.
What is the InChIKey of 6-chloro-N-(5-pyrimidin-5-yloxy-3-pyridinyl)pyridine-2-carboxamide?
The InChIKey is ZWGMNPNWKHDEGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10ClN5O2/c16-14-3-1-2-13(21-14)15(22)20-10-4-11(6-17-5-10)23-12-7-18-9-19-8-12/h1-9H,(H,20,22).
What are the key properties of 6-chloro-N-(5-pyrimidin-5-yloxy-3-pyridinyl)pyridine-2-carboxamide?
6-chloro-N-(5-pyrimidin-5-yloxy-3-pyridinyl)pyridine-2-carboxamide has a molecular weight of 327.73 g/mol, XLogP of 2.96, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(5-pyrimidin-5-yloxy-3-pyridinyl)pyridine-2-carboxamide is sourced from PubChem (CID 58349107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).