4-[butyl(methyl)amino]-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide

C20H27N3O2 — CID 109214268

IUPAC4-[butyl(methyl)amino]-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide
SMILESCCCCN(C)c1ccnc(C(=O)NCCc2ccccc2OC)c1
InChIInChI=1S/C20H27N3O2/c1-4-5-14-23(2)17-11-13-21-18(15-17)20(24)22-12-10-16-8-6-7-9-19(16)25-3/h6-9,11,13,15H,4-5,10,12,14H2,1-3H3,(H,22,24)
InChIKeyLOLDDTZTFJOROV-UHFFFAOYSA-N
MW341.46 g/mol
LogP3.30
Rot. Bonds9

About 4-[butyl(methyl)amino]-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide

4-[butyl(methyl)amino]-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide (PubChem CID 109214268) has the molecular formula C20H27N3O2 and a molecular weight of 341.46 g/mol. Its IUPAC name is 4-[butyl(methyl)amino]-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-[butyl(methyl)amino]-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide
PubChem CID109214268
Molecular FormulaC20H27N3O2
Molecular Weight341.46 g/mol
Exact Mass341.21
IUPAC Name4-[butyl(methyl)amino]-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide
SMILESCCCCN(C)c1ccnc(C(=O)NCCc2ccccc2OC)c1
InChIInChI=1S/C20H27N3O2/c1-4-5-14-23(2)17-11-13-21-18(15-17)20(24)22-12-10-16-8-6-7-9-19(16)25-3/h6-9,11,13,15H,4-5,10,12,14H2,1-3H3,(H,22,24)
InChIKeyLOLDDTZTFJOROV-UHFFFAOYSA-N
XLogP3.30
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.46
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(2-methoxyphenyl)ethyl]-4-[methyl(2-pyridin-4-ylethyl)amino]pyridine-2-carboxamide
CID 109214259
4-[benzyl(methyl)amino]-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide
CID 109211018
2-[butyl(methyl)amino]-N-[2-(2-methoxyphenyl)ethyl]pyrimidine-4-carboxamide
CID 109308623
4-[butyl(methyl)amino]-N-(2-methoxyphenyl)pyridine-2-carboxamide
CID 109217852
4-[butyl(methyl)amino]-N-pentylpyridine-2-carboxamide
CID 109217497
N-[2-(2-methoxyphenyl)ethyl]-4-(pentylamino)pyridine-2-carboxamide
CID 109214267
N-butyl-4-[2-(2-methoxyphenyl)ethylamino]pyridine-2-carboxamide
CID 109202505
4-amino-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide
CID 106262005
4-(dipropylamino)-N-[(2-methoxyphenyl)methyl]pyridine-2-carboxamide
CID 109211971
4-(2-ethylanilino)-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide
CID 109214285
6-(butylamino)-N-[2-(2-methoxyphenyl)ethyl]pyrimidine-4-carboxamide
CID 109339848
2-N,2-N-diethyl-4-N-[2-(2-methoxyphenyl)ethyl]pyridine-2,4-dicarboxamide
CID 109088102

Frequently Asked Questions

What is the IUPAC name of 4-[butyl(methyl)amino]-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide?
The IUPAC name of 4-[butyl(methyl)amino]-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide (CID 109214268) is 4-[butyl(methyl)amino]-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide.
What is the SMILES notation for 4-[butyl(methyl)amino]-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide?
The canonical SMILES for 4-[butyl(methyl)amino]-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide is CCCCN(C)c1ccnc(C(=O)NCCc2ccccc2OC)c1.
What is the InChIKey of 4-[butyl(methyl)amino]-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide?
The InChIKey is LOLDDTZTFJOROV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N3O2/c1-4-5-14-23(2)17-11-13-21-18(15-17)20(24)22-12-10-16-8-6-7-9-19(16)25-3/h6-9,11,13,15H,4-5,10,12,14H2,1-3H3,(H,22,24).
What are the key properties of 4-[butyl(methyl)amino]-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide?
4-[butyl(methyl)amino]-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide has a molecular weight of 341.46 g/mol, XLogP of 3.30, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[butyl(methyl)amino]-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide is sourced from PubChem (CID 109214268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).