N-cyclopentyl-6-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)pyridine-2-carboxamide

C22H28N2O4 — CID 139945134

IUPACN-cyclopentyl-6-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)pyridine-2-carboxamide
SMILESCOCCN(C(=O)c1cccc(-c2ccc(OC)c(OC)c2)n1)C1CCCC1
InChIInChI=1S/C22H28N2O4/c1-26-14-13-24(17-7-4-5-8-17)22(25)19-10-6-9-18(23-19)16-11-12-20(27-2)21(15-16)28-3/h6,9-12,15,17H,4-5,7-8,13-14H2,1-3H3
InChIKeyFJGWCMWRLIEYQR-UHFFFAOYSA-N
MW384.48 g/mol
LogP3.80
Rot. Bonds8

About N-cyclopentyl-6-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)pyridine-2-carboxamide

N-cyclopentyl-6-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)pyridine-2-carboxamide (PubChem CID 139945134) has the molecular formula C22H28N2O4 and a molecular weight of 384.48 g/mol. Its IUPAC name is N-cyclopentyl-6-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-6-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)pyridine-2-carboxamide
PubChem CID139945134
Molecular FormulaC22H28N2O4
Molecular Weight384.48 g/mol
Exact Mass384.20
IUPAC NameN-cyclopentyl-6-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)pyridine-2-carboxamide
SMILESCOCCN(C(=O)c1cccc(-c2ccc(OC)c(OC)c2)n1)C1CCCC1
InChIInChI=1S/C22H28N2O4/c1-26-14-13-24(17-7-4-5-8-17)22(25)19-10-6-9-18(23-19)16-11-12-20(27-2)21(15-16)28-3/h6,9-12,15,17H,4-5,7-8,13-14H2,1-3H3
InChIKeyFJGWCMWRLIEYQR-UHFFFAOYSA-N
XLogP3.80
TPSA60.89 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.48
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclopropyl-6-fluoro-N-(2-methoxyethyl)pyridine-2-carboxamide
CID 115497501
N-cyclohexyl-N-[[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-3-fluorobenzamide
CID 6494663
N-cyclohexyl-N-[[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-2,5-dimethylbenzamide
CID 6494950
N-cyclopentyl-N-(2-methoxyethyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide
CID 75405120
N-cyclohexyl-N-[2-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl]-4-(trifluoromethyl)benzamide
CID 83285428
1-cyclohexyl-1-[[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-3-propylurea
CID 8895983
1-cyclohexyl-1-[[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-3-phenylurea
CID 17275257
[3,5-dimethoxy-4-(2-methoxyethoxy)phenyl]-[6-(4-methylphenyl)-2-pyridinyl]methanone
CID 166633354
6-(3-hydroxy-4-methoxyphenyl)pyridine-2-carboxylic acid
CID 141058986
6-chloro-N-cyclopentyl-N-(2-hydroxyethyl)pyridine-2-carboxamide
CID 55211893
6-[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]-N,N-dimethylpyridine-2-carboxamide
CID 142633358
[6-(3,4-dimethoxyphenyl)-2-pyridinyl]-[4-(4-hydroxyphenyl)piperazin-1-yl]methanone
CID 18444282

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-6-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)pyridine-2-carboxamide?
The IUPAC name of N-cyclopentyl-6-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)pyridine-2-carboxamide (CID 139945134) is N-cyclopentyl-6-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)pyridine-2-carboxamide.
What is the SMILES notation for N-cyclopentyl-6-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)pyridine-2-carboxamide?
The canonical SMILES for N-cyclopentyl-6-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)pyridine-2-carboxamide is COCCN(C(=O)c1cccc(-c2ccc(OC)c(OC)c2)n1)C1CCCC1.
What is the InChIKey of N-cyclopentyl-6-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)pyridine-2-carboxamide?
The InChIKey is FJGWCMWRLIEYQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O4/c1-26-14-13-24(17-7-4-5-8-17)22(25)19-10-6-9-18(23-19)16-11-12-20(27-2)21(15-16)28-3/h6,9-12,15,17H,4-5,7-8,13-14H2,1-3H3.
What are the key properties of N-cyclopentyl-6-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)pyridine-2-carboxamide?
N-cyclopentyl-6-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)pyridine-2-carboxamide has a molecular weight of 384.48 g/mol, XLogP of 3.80, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-6-(3,4-dimethoxyphenyl)-N-(2-methoxyethyl)pyridine-2-carboxamide is sourced from PubChem (CID 139945134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).