5-chloro-6-[methyl-(4-phenylcyclohexyl)amino]pyridine-3-carboxamide

C19H22ClN3O — CID 75415933

IUPAC5-chloro-6-[methyl-(4-phenylcyclohexyl)amino]pyridine-3-carboxamide
SMILESCN(c1ncc(C(N)=O)cc1Cl)C1CCC(c2ccccc2)CC1
InChIInChI=1S/C19H22ClN3O/c1-23(19-17(20)11-15(12-22-19)18(21)24)16-9-7-14(8-10-16)13-5-3-2-4-6-13/h2-6,11-12,14,16H,7-10H2,1H3,(H2,21,24)
InChIKeyKNYYIGWYVSNTRW-UHFFFAOYSA-N
MW343.86 g/mol
LogP4.00
Rot. Bonds4

About 5-chloro-6-[methyl-(4-phenylcyclohexyl)amino]pyridine-3-carboxamide

5-chloro-6-[methyl-(4-phenylcyclohexyl)amino]pyridine-3-carboxamide (PubChem CID 75415933) has the molecular formula C19H22ClN3O and a molecular weight of 343.86 g/mol. Its IUPAC name is 5-chloro-6-[methyl-(4-phenylcyclohexyl)amino]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-6-[methyl-(4-phenylcyclohexyl)amino]pyridine-3-carboxamide
PubChem CID75415933
Molecular FormulaC19H22ClN3O
Molecular Weight343.86 g/mol
Exact Mass343.15
IUPAC Name5-chloro-6-[methyl-(4-phenylcyclohexyl)amino]pyridine-3-carboxamide
SMILESCN(c1ncc(C(N)=O)cc1Cl)C1CCC(c2ccccc2)CC1
InChIInChI=1S/C19H22ClN3O/c1-23(19-17(20)11-15(12-22-19)18(21)24)16-9-7-14(8-10-16)13-5-3-2-4-6-13/h2-6,11-12,14,16H,7-10H2,1H3,(H2,21,24)
InChIKeyKNYYIGWYVSNTRW-UHFFFAOYSA-N
XLogP4.00
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.86
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-[methyl-(4-phenylcyclohexyl)amino]pyridine-3-carboxamide?
The IUPAC name of 5-chloro-6-[methyl-(4-phenylcyclohexyl)amino]pyridine-3-carboxamide (CID 75415933) is 5-chloro-6-[methyl-(4-phenylcyclohexyl)amino]pyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-6-[methyl-(4-phenylcyclohexyl)amino]pyridine-3-carboxamide?
The canonical SMILES for 5-chloro-6-[methyl-(4-phenylcyclohexyl)amino]pyridine-3-carboxamide is CN(c1ncc(C(N)=O)cc1Cl)C1CCC(c2ccccc2)CC1.
What is the InChIKey of 5-chloro-6-[methyl-(4-phenylcyclohexyl)amino]pyridine-3-carboxamide?
The InChIKey is KNYYIGWYVSNTRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22ClN3O/c1-23(19-17(20)11-15(12-22-19)18(21)24)16-9-7-14(8-10-16)13-5-3-2-4-6-13/h2-6,11-12,14,16H,7-10H2,1H3,(H2,21,24).
What are the key properties of 5-chloro-6-[methyl-(4-phenylcyclohexyl)amino]pyridine-3-carboxamide?
5-chloro-6-[methyl-(4-phenylcyclohexyl)amino]pyridine-3-carboxamide has a molecular weight of 343.86 g/mol, XLogP of 4.00, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-[methyl-(4-phenylcyclohexyl)amino]pyridine-3-carboxamide is sourced from PubChem (CID 75415933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).