5-(dipropylamino)-N-(3,4,5-trimethoxyphenyl)pyridine-3-carboxamide

C21H29N3O4 — CID 109241100

IUPAC5-(dipropylamino)-N-(3,4,5-trimethoxyphenyl)pyridine-3-carboxamide
SMILESCCCN(CCC)c1cncc(C(=O)Nc2cc(OC)c(OC)c(OC)c2)c1
InChIInChI=1S/C21H29N3O4/c1-6-8-24(9-7-2)17-10-15(13-22-14-17)21(25)23-16-11-18(26-3)20(28-5)19(12-16)27-4/h10-14H,6-9H2,1-5H3,(H,23,25)
InChIKeyZTHCXXZANVOEAL-UHFFFAOYSA-N
MW387.48 g/mol
LogP3.99
Rot. Bonds10

About 5-(dipropylamino)-N-(3,4,5-trimethoxyphenyl)pyridine-3-carboxamide

5-(dipropylamino)-N-(3,4,5-trimethoxyphenyl)pyridine-3-carboxamide (PubChem CID 109241100) has the molecular formula C21H29N3O4 and a molecular weight of 387.48 g/mol. Its IUPAC name is 5-(dipropylamino)-N-(3,4,5-trimethoxyphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-(dipropylamino)-N-(3,4,5-trimethoxyphenyl)pyridine-3-carboxamide
PubChem CID109241100
Molecular FormulaC21H29N3O4
Molecular Weight387.48 g/mol
Exact Mass387.22
IUPAC Name5-(dipropylamino)-N-(3,4,5-trimethoxyphenyl)pyridine-3-carboxamide
SMILESCCCN(CCC)c1cncc(C(=O)Nc2cc(OC)c(OC)c(OC)c2)c1
InChIInChI=1S/C21H29N3O4/c1-6-8-24(9-7-2)17-10-15(13-22-14-17)21(25)23-16-11-18(26-3)20(28-5)19(12-16)27-4/h10-14H,6-9H2,1-5H3,(H,23,25)
InChIKeyZTHCXXZANVOEAL-UHFFFAOYSA-N
XLogP3.99
TPSA72.92 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.48
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-bromo-N-(3,4,5-trimethoxyphenyl)pyridine-3-carboxamide
CID 1267701
6-(dipropylamino)-N-(3,4,5-trimethoxyphenyl)pyridine-3-carboxamide
CID 109161852
5-(dipropylamino)-N-phenylpyridine-3-carboxamide
CID 109241022
N-(4-acetamidophenyl)-5-(dipropylamino)pyridine-3-carboxamide
CID 109241075
N-[4-(dimethylamino)phenyl]-5-(dipropylamino)pyridine-3-carboxamide
CID 109241081
5-(propan-2-ylamino)-N-(3,4,5-trimethoxyphenyl)pyridine-3-carboxamide
CID 109223529
N-(3-bromo-4-methylphenyl)-5-(dipropylamino)pyridine-3-carboxamide
CID 109241057
5-(pyrrolidine-1-carbonyl)-N-(3,4,5-trimethoxyphenyl)pyridine-3-carboxamide
CID 109102640
N-(2-bromophenyl)-5-(dipropylamino)pyridine-3-carboxamide
CID 109241090
N-(2-bromo-4-methylphenyl)-5-(dipropylamino)pyridine-3-carboxamide
CID 109241092
N-(3,4-dimethoxyphenyl)-5-(N-ethylanilino)pyridine-3-carboxamide
CID 109243640
4-ethoxy-3-methoxy-N-(3,4,5-trimethoxyphenyl)benzamide
CID 26698623

Frequently Asked Questions

What is the IUPAC name of 5-(dipropylamino)-N-(3,4,5-trimethoxyphenyl)pyridine-3-carboxamide?
The IUPAC name of 5-(dipropylamino)-N-(3,4,5-trimethoxyphenyl)pyridine-3-carboxamide (CID 109241100) is 5-(dipropylamino)-N-(3,4,5-trimethoxyphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-(dipropylamino)-N-(3,4,5-trimethoxyphenyl)pyridine-3-carboxamide?
The canonical SMILES for 5-(dipropylamino)-N-(3,4,5-trimethoxyphenyl)pyridine-3-carboxamide is CCCN(CCC)c1cncc(C(=O)Nc2cc(OC)c(OC)c(OC)c2)c1.
What is the InChIKey of 5-(dipropylamino)-N-(3,4,5-trimethoxyphenyl)pyridine-3-carboxamide?
The InChIKey is ZTHCXXZANVOEAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H29N3O4/c1-6-8-24(9-7-2)17-10-15(13-22-14-17)21(25)23-16-11-18(26-3)20(28-5)19(12-16)27-4/h10-14H,6-9H2,1-5H3,(H,23,25).
What are the key properties of 5-(dipropylamino)-N-(3,4,5-trimethoxyphenyl)pyridine-3-carboxamide?
5-(dipropylamino)-N-(3,4,5-trimethoxyphenyl)pyridine-3-carboxamide has a molecular weight of 387.48 g/mol, XLogP of 3.99, 10 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(dipropylamino)-N-(3,4,5-trimethoxyphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 109241100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).