6-(dipropylamino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide

C20H27N3O2 — CID 109161821

IUPAC6-(dipropylamino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide
SMILESCCCN(CCC)c1ccc(C(=O)Nc2cc(C)ccc2OC)cn1
InChIInChI=1S/C20H27N3O2/c1-5-11-23(12-6-2)19-10-8-16(14-21-19)20(24)22-17-13-15(3)7-9-18(17)25-4/h7-10,13-14H,5-6,11-12H2,1-4H3,(H,22,24)
InChIKeyAQRGVLYKDOLOEI-UHFFFAOYSA-N
MW341.46 g/mol
LogP4.28
Rot. Bonds8

About 6-(dipropylamino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide

6-(dipropylamino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide (PubChem CID 109161821) has the molecular formula C20H27N3O2 and a molecular weight of 341.46 g/mol. Its IUPAC name is 6-(dipropylamino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(dipropylamino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide
PubChem CID109161821
Molecular FormulaC20H27N3O2
Molecular Weight341.46 g/mol
Exact Mass341.21
IUPAC Name6-(dipropylamino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide
SMILESCCCN(CCC)c1ccc(C(=O)Nc2cc(C)ccc2OC)cn1
InChIInChI=1S/C20H27N3O2/c1-5-11-23(12-6-2)19-10-8-16(14-21-19)20(24)22-17-13-15(3)7-9-18(17)25-4/h7-10,13-14H,5-6,11-12H2,1-4H3,(H,22,24)
InChIKeyAQRGVLYKDOLOEI-UHFFFAOYSA-N
XLogP4.28
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.46
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(dipropylamino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide?
The IUPAC name of 6-(dipropylamino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide (CID 109161821) is 6-(dipropylamino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-(dipropylamino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 6-(dipropylamino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide is CCCN(CCC)c1ccc(C(=O)Nc2cc(C)ccc2OC)cn1.
What is the InChIKey of 6-(dipropylamino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide?
The InChIKey is AQRGVLYKDOLOEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N3O2/c1-5-11-23(12-6-2)19-10-8-16(14-21-19)20(24)22-17-13-15(3)7-9-18(17)25-4/h7-10,13-14H,5-6,11-12H2,1-4H3,(H,22,24).
What are the key properties of 6-(dipropylamino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide?
6-(dipropylamino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide has a molecular weight of 341.46 g/mol, XLogP of 4.28, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(dipropylamino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 109161821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).