5-chloro-N-(2-hydroxycyclohexyl)-6-(methylamino)pyridine-3-carboxamide

C13H18ClN3O2 — CID 55063853

IUPAC5-chloro-N-(2-hydroxycyclohexyl)-6-(methylamino)pyridine-3-carboxamide
SMILESCNc1ncc(C(=O)NC2CCCCC2O)cc1Cl
InChIInChI=1S/C13H18ClN3O2/c1-15-12-9(14)6-8(7-16-12)13(19)17-10-4-2-3-5-11(10)18/h6-7,10-11,18H,2-5H2,1H3,(H,15,16)(H,17,19)
InChIKeyRPISPOWWGNZDCT-UHFFFAOYSA-N
MW283.76 g/mol
LogP1.81
Rot. Bonds3

About 5-chloro-N-(2-hydroxycyclohexyl)-6-(methylamino)pyridine-3-carboxamide

5-chloro-N-(2-hydroxycyclohexyl)-6-(methylamino)pyridine-3-carboxamide (PubChem CID 55063853) has the molecular formula C13H18ClN3O2 and a molecular weight of 283.76 g/mol. Its IUPAC name is 5-chloro-N-(2-hydroxycyclohexyl)-6-(methylamino)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(2-hydroxycyclohexyl)-6-(methylamino)pyridine-3-carboxamide
PubChem CID55063853
Molecular FormulaC13H18ClN3O2
Molecular Weight283.76 g/mol
Exact Mass283.11
IUPAC Name5-chloro-N-(2-hydroxycyclohexyl)-6-(methylamino)pyridine-3-carboxamide
SMILESCNc1ncc(C(=O)NC2CCCCC2O)cc1Cl
InChIInChI=1S/C13H18ClN3O2/c1-15-12-9(14)6-8(7-16-12)13(19)17-10-4-2-3-5-11(10)18/h6-7,10-11,18H,2-5H2,1H3,(H,15,16)(H,17,19)
InChIKeyRPISPOWWGNZDCT-UHFFFAOYSA-N
XLogP1.81
TPSA74.25 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.76
LogP ≤ 51.81
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-6-(methylamino)-N-(2-methylcyclopropyl)pyridine-3-carboxamide
CID 62409249
N-(1-azabicyclo[2.2.2]octan-3-yl)-5-chloro-6-(methylamino)pyridine-3-carboxamide
CID 62167795
5-chloro-6-(methylamino)-N-(4-methylcyclohexyl)pyridine-3-carboxamide
CID 55042305
5-chloro-N-(2-hydroxycyclohexyl)-N-methyl-6-(methylamino)pyridine-3-carboxamide
CID 102636771
5-chloro-N-(3-methoxycyclobutyl)-6-(methylamino)pyridine-3-carboxamide
CID 114120797
5-chloro-N-(2-cyclopentyloxyethyl)-6-(methylamino)pyridine-3-carboxamide
CID 63834843
3-chloro-N-[(1S,2S)-2-hydroxycyclohexyl]-4-methylbenzamide
CID 104956646
5-chloro-N-(2,2-dimethyloxan-4-yl)-6-(methylamino)pyridine-3-carboxamide
CID 83039415
5,6-dichloro-N-(2-propan-2-ylcyclohexyl)pyridine-3-carboxamide
CID 78926017
3-chloro-N-(2-hydroxycyclohexyl)-4-iodobenzamide
CID 103855445
5-(2,4-dichlorophenyl)-N-(2-hydroxycyclohexyl)-6-pentoxypyridine-3-carboxamide
CID 21109591
N-(2-hydroxycyclohexyl)-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide
CID 62359400

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2-hydroxycyclohexyl)-6-(methylamino)pyridine-3-carboxamide?
The IUPAC name of 5-chloro-N-(2-hydroxycyclohexyl)-6-(methylamino)pyridine-3-carboxamide (CID 55063853) is 5-chloro-N-(2-hydroxycyclohexyl)-6-(methylamino)pyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-N-(2-hydroxycyclohexyl)-6-(methylamino)pyridine-3-carboxamide?
The canonical SMILES for 5-chloro-N-(2-hydroxycyclohexyl)-6-(methylamino)pyridine-3-carboxamide is CNc1ncc(C(=O)NC2CCCCC2O)cc1Cl.
What is the InChIKey of 5-chloro-N-(2-hydroxycyclohexyl)-6-(methylamino)pyridine-3-carboxamide?
The InChIKey is RPISPOWWGNZDCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18ClN3O2/c1-15-12-9(14)6-8(7-16-12)13(19)17-10-4-2-3-5-11(10)18/h6-7,10-11,18H,2-5H2,1H3,(H,15,16)(H,17,19).
What are the key properties of 5-chloro-N-(2-hydroxycyclohexyl)-6-(methylamino)pyridine-3-carboxamide?
5-chloro-N-(2-hydroxycyclohexyl)-6-(methylamino)pyridine-3-carboxamide has a molecular weight of 283.76 g/mol, XLogP of 1.81, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2-hydroxycyclohexyl)-6-(methylamino)pyridine-3-carboxamide is sourced from PubChem (CID 55063853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).