3-(3,4-dimethoxyphenyl)-N-(5-pyrrolidin-1-yl-2-pyridinyl)propanamide

C20H25N3O3 — CID 32946707

IUPAC3-(3,4-dimethoxyphenyl)-N-(5-pyrrolidin-1-yl-2-pyridinyl)propanamide
SMILESCOc1ccc(CCC(=O)Nc2ccc(N3CCCC3)cn2)cc1OC
InChIInChI=1S/C20H25N3O3/c1-25-17-8-5-15(13-18(17)26-2)6-10-20(24)22-19-9-7-16(14-21-19)23-11-3-4-12-23/h5,7-9,13-14H,3-4,6,10-12H2,1-2H3,(H,21,22,24)
InChIKeyGIXSFNQDVPZNOY-UHFFFAOYSA-N
MW355.44 g/mol
LogP3.27
Rot. Bonds7

About 3-(3,4-dimethoxyphenyl)-N-(5-pyrrolidin-1-yl-2-pyridinyl)propanamide

3-(3,4-dimethoxyphenyl)-N-(5-pyrrolidin-1-yl-2-pyridinyl)propanamide (PubChem CID 32946707) has the molecular formula C20H25N3O3 and a molecular weight of 355.44 g/mol. Its IUPAC name is 3-(3,4-dimethoxyphenyl)-N-(5-pyrrolidin-1-yl-2-pyridinyl)propanamide.

Molecular Properties

Compound Name3-(3,4-dimethoxyphenyl)-N-(5-pyrrolidin-1-yl-2-pyridinyl)propanamide
PubChem CID32946707
Molecular FormulaC20H25N3O3
Molecular Weight355.44 g/mol
Exact Mass355.19
IUPAC Name3-(3,4-dimethoxyphenyl)-N-(5-pyrrolidin-1-yl-2-pyridinyl)propanamide
SMILESCOc1ccc(CCC(=O)Nc2ccc(N3CCCC3)cn2)cc1OC
InChIInChI=1S/C20H25N3O3/c1-25-17-8-5-15(13-18(17)26-2)6-10-20(24)22-19-9-7-16(14-21-19)23-11-3-4-12-23/h5,7-9,13-14H,3-4,6,10-12H2,1-2H3,(H,21,22,24)
InChIKeyGIXSFNQDVPZNOY-UHFFFAOYSA-N
XLogP3.27
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(3,4-dimethoxyphenyl)-N-[5-(4-formylpiperazin-1-yl)-2-pyridinyl]propanamide
CID 113026085
2-(3,4-dimethoxyphenyl)-N-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]acetamide
CID 113024851
3-(3,4-dimethoxyphenyl)-N-[6-(propan-2-ylamino)pyridazin-3-yl]propanamide
CID 113037967
N-[6-(tert-butylamino)-3-pyridinyl]-3-(3,4-dimethoxyphenyl)propanamide
CID 113014809
N-[5-(azepan-1-yl)-2-pyridinyl]propanamide
CID 39072195
3-(4-methylphenyl)-N-(5-piperazin-1-yl-2-pyridinyl)propanamide
CID 119494095
3-(3,4-dimethoxyphenyl)-N-[5-(3-methylanilino)-2-pyridinyl]propanamide
CID 113031455
N-[6-(tert-butylamino)pyridazin-3-yl]-3-(3,4-dimethoxyphenyl)propanamide
CID 113044288
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-pyrrolidin-1-ylbenzamide
CID 110295138
4-(2-ethoxyphenoxy)-N-(5-pyrrolidin-1-yl-2-pyridinyl)butanamide
CID 32948152
4-methoxy-N-(5-piperidin-1-yl-2-pyridinyl)naphthalene-1-carboxamide
CID 112827556
3-(3-bromo-4-methoxyphenyl)-N-(5-chloro-2-pyridinyl)propanamide
CID 43054897

Frequently Asked Questions

What is the IUPAC name of 3-(3,4-dimethoxyphenyl)-N-(5-pyrrolidin-1-yl-2-pyridinyl)propanamide?
The IUPAC name of 3-(3,4-dimethoxyphenyl)-N-(5-pyrrolidin-1-yl-2-pyridinyl)propanamide (CID 32946707) is 3-(3,4-dimethoxyphenyl)-N-(5-pyrrolidin-1-yl-2-pyridinyl)propanamide.
What is the SMILES notation for 3-(3,4-dimethoxyphenyl)-N-(5-pyrrolidin-1-yl-2-pyridinyl)propanamide?
The canonical SMILES for 3-(3,4-dimethoxyphenyl)-N-(5-pyrrolidin-1-yl-2-pyridinyl)propanamide is COc1ccc(CCC(=O)Nc2ccc(N3CCCC3)cn2)cc1OC.
What is the InChIKey of 3-(3,4-dimethoxyphenyl)-N-(5-pyrrolidin-1-yl-2-pyridinyl)propanamide?
The InChIKey is GIXSFNQDVPZNOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O3/c1-25-17-8-5-15(13-18(17)26-2)6-10-20(24)22-19-9-7-16(14-21-19)23-11-3-4-12-23/h5,7-9,13-14H,3-4,6,10-12H2,1-2H3,(H,21,22,24).
What are the key properties of 3-(3,4-dimethoxyphenyl)-N-(5-pyrrolidin-1-yl-2-pyridinyl)propanamide?
3-(3,4-dimethoxyphenyl)-N-(5-pyrrolidin-1-yl-2-pyridinyl)propanamide has a molecular weight of 355.44 g/mol, XLogP of 3.27, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,4-dimethoxyphenyl)-N-(5-pyrrolidin-1-yl-2-pyridinyl)propanamide is sourced from PubChem (CID 32946707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).