N-(5-chloro-2-pyridinyl)-5-(methylamino)pyridine-2-carboxamide

C12H11ClN4O — CID 104640066

IUPACN-(5-chloro-2-pyridinyl)-5-(methylamino)pyridine-2-carboxamide
SMILESCNc1ccc(C(=O)Nc2ccc(Cl)cn2)nc1
InChIInChI=1S/C12H11ClN4O/c1-14-9-3-4-10(15-7-9)12(18)17-11-5-2-8(13)6-16-11/h2-7,14H,1H3,(H,16,17,18)
InChIKeyOKOBWOCXIDZKCL-UHFFFAOYSA-N
MW262.70 g/mol
LogP2.42
Rot. Bonds3

About N-(5-chloro-2-pyridinyl)-5-(methylamino)pyridine-2-carboxamide

N-(5-chloro-2-pyridinyl)-5-(methylamino)pyridine-2-carboxamide (PubChem CID 104640066) has the molecular formula C12H11ClN4O and a molecular weight of 262.70 g/mol. Its IUPAC name is N-(5-chloro-2-pyridinyl)-5-(methylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(5-chloro-2-pyridinyl)-5-(methylamino)pyridine-2-carboxamide
PubChem CID104640066
Molecular FormulaC12H11ClN4O
Molecular Weight262.70 g/mol
Exact Mass262.06
IUPAC NameN-(5-chloro-2-pyridinyl)-5-(methylamino)pyridine-2-carboxamide
SMILESCNc1ccc(C(=O)Nc2ccc(Cl)cn2)nc1
InChIInChI=1S/C12H11ClN4O/c1-14-9-3-4-10(15-7-9)12(18)17-11-5-2-8(13)6-16-11/h2-7,14H,1H3,(H,16,17,18)
InChIKeyOKOBWOCXIDZKCL-UHFFFAOYSA-N
XLogP2.42
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.70
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-chloro-2-pyridinyl)-5-(ethylamino)pyridine-2-carboxamide
CID 104640067
N-(3,5-dichlorophenyl)-5-(methylamino)pyridine-2-carboxamide
CID 104639754
N-(3,4-dichlorophenyl)-5-(methylamino)pyridine-2-carboxamide
CID 104639765
2-N,6-N-bis(5-chloro-2-pyridinyl)pyridine-2,6-dicarboxamide
CID 3421113
N-(5-chloro-2-pyridinyl)-2-methylbenzamide
CID 758009
5-(methylamino)-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide
CID 104640352
4,5-dichloro-1-N,2-N-bis(5-chloro-2-pyridinyl)benzene-1,2-dicarboxamide
CID 3421055
5-(methylamino)-N-(2,4,5-trifluorophenyl)pyridine-2-carboxamide
CID 104641160
N-(5-chloro-2-pyridinyl)-5-(propylamino)pyrazine-2-carboxamide
CID 107374336
N-(5-chloro-2-pyridinyl)-4-(propanoylamino)benzamide
CID 2988082
N',N'-dimethyl-5-(methylamino)pyridine-2-carbohydrazide
CID 104641981
N-(5-chloro-2-pyridinyl)-4-hydroxy-5-methyl-2-[[4-(methylamino)benzoyl]amino]benzamide
CID 153409491

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-pyridinyl)-5-(methylamino)pyridine-2-carboxamide?
The IUPAC name of N-(5-chloro-2-pyridinyl)-5-(methylamino)pyridine-2-carboxamide (CID 104640066) is N-(5-chloro-2-pyridinyl)-5-(methylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-(5-chloro-2-pyridinyl)-5-(methylamino)pyridine-2-carboxamide?
The canonical SMILES for N-(5-chloro-2-pyridinyl)-5-(methylamino)pyridine-2-carboxamide is CNc1ccc(C(=O)Nc2ccc(Cl)cn2)nc1.
What is the InChIKey of N-(5-chloro-2-pyridinyl)-5-(methylamino)pyridine-2-carboxamide?
The InChIKey is OKOBWOCXIDZKCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClN4O/c1-14-9-3-4-10(15-7-9)12(18)17-11-5-2-8(13)6-16-11/h2-7,14H,1H3,(H,16,17,18).
What are the key properties of N-(5-chloro-2-pyridinyl)-5-(methylamino)pyridine-2-carboxamide?
N-(5-chloro-2-pyridinyl)-5-(methylamino)pyridine-2-carboxamide has a molecular weight of 262.70 g/mol, XLogP of 2.42, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-pyridinyl)-5-(methylamino)pyridine-2-carboxamide is sourced from PubChem (CID 104640066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).