N-[5-(diethylamino)-2-pyridinyl]-3,5-dimethoxybenzamide

C18H23N3O3 — CID 113029690

IUPACN-[5-(diethylamino)-2-pyridinyl]-3,5-dimethoxybenzamide
SMILESCCN(CC)c1ccc(NC(=O)c2cc(OC)cc(OC)c2)nc1
InChIInChI=1S/C18H23N3O3/c1-5-21(6-2)14-7-8-17(19-12-14)20-18(22)13-9-15(23-3)11-16(10-13)24-4/h7-12H,5-6H2,1-4H3,(H,19,20,22)
InChIKeyFIRWNOATLHDWFI-UHFFFAOYSA-N
MW329.40 g/mol
LogP3.20
Rot. Bonds7

About N-[5-(diethylamino)-2-pyridinyl]-3,5-dimethoxybenzamide

N-[5-(diethylamino)-2-pyridinyl]-3,5-dimethoxybenzamide (PubChem CID 113029690) has the molecular formula C18H23N3O3 and a molecular weight of 329.40 g/mol. Its IUPAC name is N-[5-(diethylamino)-2-pyridinyl]-3,5-dimethoxybenzamide.

Molecular Properties

Compound NameN-[5-(diethylamino)-2-pyridinyl]-3,5-dimethoxybenzamide
PubChem CID113029690
Molecular FormulaC18H23N3O3
Molecular Weight329.40 g/mol
Exact Mass329.17
IUPAC NameN-[5-(diethylamino)-2-pyridinyl]-3,5-dimethoxybenzamide
SMILESCCN(CC)c1ccc(NC(=O)c2cc(OC)cc(OC)c2)nc1
InChIInChI=1S/C18H23N3O3/c1-5-21(6-2)14-7-8-17(19-12-14)20-18(22)13-9-15(23-3)11-16(10-13)24-4/h7-12H,5-6H2,1-4H3,(H,19,20,22)
InChIKeyFIRWNOATLHDWFI-UHFFFAOYSA-N
XLogP3.20
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.40
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[5-[4-(diethylamino)anilino]-2-pyridinyl]-3-methoxybenzamide
CID 113035591
N-[6-(diethylamino)pyrimidin-4-yl]-3,5-dimethoxybenzamide
CID 65389157
3,5-dimethoxy-N-(5-nitro-2-pyridinyl)benzamide
CID 2862603
N-[5-(2,6-dimethylanilino)-2-pyridinyl]-3,5-dimethoxybenzamide
CID 113032259
N-[5-(2-ethylanilino)-2-pyridinyl]-3,5-dimethoxybenzamide
CID 113032412
N-[5-(2-ethyl-6-methylanilino)-2-pyridinyl]-3,5-dimethoxybenzamide
CID 113032663
N-[6-(dipropylamino)pyridazin-3-yl]-3,5-dimethoxybenzamide
CID 113045149
3-amino-5-methoxy-N-(5-methyl-2-pyridinyl)benzamide
CID 81090786
N-[5-(dipropylamino)-2-pyridinyl]-2,6-dimethoxybenzamide
CID 113030910
N-[6-(N-ethyl-3-methylanilino)-3-pyridinyl]-3,5-dimethoxybenzamide
CID 113022970
N-[5-[(1,1-dioxothiolan-3-yl)-ethylamino]-2-pyridinyl]-3-methoxybenzamide
CID 113029197
1-[5-(diethylamino)-2-pyridinyl]-3-propan-2-ylurea
CID 113029739

Frequently Asked Questions

What is the IUPAC name of N-[5-(diethylamino)-2-pyridinyl]-3,5-dimethoxybenzamide?
The IUPAC name of N-[5-(diethylamino)-2-pyridinyl]-3,5-dimethoxybenzamide (CID 113029690) is N-[5-(diethylamino)-2-pyridinyl]-3,5-dimethoxybenzamide.
What is the SMILES notation for N-[5-(diethylamino)-2-pyridinyl]-3,5-dimethoxybenzamide?
The canonical SMILES for N-[5-(diethylamino)-2-pyridinyl]-3,5-dimethoxybenzamide is CCN(CC)c1ccc(NC(=O)c2cc(OC)cc(OC)c2)nc1.
What is the InChIKey of N-[5-(diethylamino)-2-pyridinyl]-3,5-dimethoxybenzamide?
The InChIKey is FIRWNOATLHDWFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O3/c1-5-21(6-2)14-7-8-17(19-12-14)20-18(22)13-9-15(23-3)11-16(10-13)24-4/h7-12H,5-6H2,1-4H3,(H,19,20,22).
What are the key properties of N-[5-(diethylamino)-2-pyridinyl]-3,5-dimethoxybenzamide?
N-[5-(diethylamino)-2-pyridinyl]-3,5-dimethoxybenzamide has a molecular weight of 329.40 g/mol, XLogP of 3.20, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(diethylamino)-2-pyridinyl]-3,5-dimethoxybenzamide is sourced from PubChem (CID 113029690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).