N-(furan-2-ylmethyl)-2-[2-(3-methoxyphenyl)ethylamino]pyridine-4-carboxamide

C20H21N3O3 — CID 109169233

IUPACN-(furan-2-ylmethyl)-2-[2-(3-methoxyphenyl)ethylamino]pyridine-4-carboxamide
SMILESCOc1cccc(CCNc2cc(C(=O)NCc3ccco3)ccn2)c1
InChIInChI=1S/C20H21N3O3/c1-25-17-5-2-4-15(12-17)7-9-21-19-13-16(8-10-22-19)20(24)23-14-18-6-3-11-26-18/h2-6,8,10-13H,7,9,14H2,1H3,(H,21,22)(H,23,24)
InChIKeyIWTXLQKFUPNPGW-UHFFFAOYSA-N
MW351.41 g/mol
LogP3.27
Rot. Bonds8

About N-(furan-2-ylmethyl)-2-[2-(3-methoxyphenyl)ethylamino]pyridine-4-carboxamide

N-(furan-2-ylmethyl)-2-[2-(3-methoxyphenyl)ethylamino]pyridine-4-carboxamide (PubChem CID 109169233) has the molecular formula C20H21N3O3 and a molecular weight of 351.41 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-2-[2-(3-methoxyphenyl)ethylamino]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-2-[2-(3-methoxyphenyl)ethylamino]pyridine-4-carboxamide
PubChem CID109169233
Molecular FormulaC20H21N3O3
Molecular Weight351.41 g/mol
Exact Mass351.16
IUPAC NameN-(furan-2-ylmethyl)-2-[2-(3-methoxyphenyl)ethylamino]pyridine-4-carboxamide
SMILESCOc1cccc(CCNc2cc(C(=O)NCc3ccco3)ccn2)c1
InChIInChI=1S/C20H21N3O3/c1-25-17-5-2-4-15(12-17)7-9-21-19-13-16(8-10-22-19)20(24)23-14-18-6-3-11-26-18/h2-6,8,10-13H,7,9,14H2,1H3,(H,21,22)(H,23,24)
InChIKeyIWTXLQKFUPNPGW-UHFFFAOYSA-N
XLogP3.27
TPSA76.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[2-(3-methoxyphenyl)ethylamino]-N-propylpyridine-4-carboxamide
CID 109165037
2-(benzylamino)-N-[2-(3-methoxyphenyl)ethyl]pyridine-4-carboxamide
CID 109169514
N-(furan-2-ylmethyl)-2-(propylamino)pyridine-4-carboxamide
CID 62172710
2-[2-(3-methoxyphenyl)ethylamino]-N-(4-methylphenyl)pyridine-4-carboxamide
CID 109172917
2-hydrazinyl-N-[(3-methoxyphenyl)methyl]pyridine-4-carboxamide
CID 62237337
2-(2,4-dimethoxyanilino)-N-(furan-2-ylmethyl)pyridine-4-carboxamide
CID 109169277
2-(furan-2-ylmethylamino)-N-[2-(2-methoxyphenyl)ethyl]pyridine-4-carboxamide
CID 109169326
N-(4-ethoxyphenyl)-2-[2-(3-methoxyphenyl)ethylamino]pyridine-4-carboxamide
CID 109172946
N-(3,4-difluorophenyl)-2-[2-(3-methoxyphenyl)ethylamino]pyridine-4-carboxamide
CID 109172961
2-(cyclopropylamino)-N-[2-(3-methoxyphenyl)ethyl]pyridine-4-carboxamide
CID 109165237
2-[2-(4-methoxyphenyl)ethylamino]-N-[(4-methylphenyl)methyl]pyridine-4-carboxamide
CID 109169909
N-[2-(3-methoxyphenyl)ethyl]-2-(1-phenylethylamino)pyridine-4-carboxamide
CID 109170133

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-2-[2-(3-methoxyphenyl)ethylamino]pyridine-4-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)-2-[2-(3-methoxyphenyl)ethylamino]pyridine-4-carboxamide (CID 109169233) is N-(furan-2-ylmethyl)-2-[2-(3-methoxyphenyl)ethylamino]pyridine-4-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-2-[2-(3-methoxyphenyl)ethylamino]pyridine-4-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)-2-[2-(3-methoxyphenyl)ethylamino]pyridine-4-carboxamide is COc1cccc(CCNc2cc(C(=O)NCc3ccco3)ccn2)c1.
What is the InChIKey of N-(furan-2-ylmethyl)-2-[2-(3-methoxyphenyl)ethylamino]pyridine-4-carboxamide?
The InChIKey is IWTXLQKFUPNPGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O3/c1-25-17-5-2-4-15(12-17)7-9-21-19-13-16(8-10-22-19)20(24)23-14-18-6-3-11-26-18/h2-6,8,10-13H,7,9,14H2,1H3,(H,21,22)(H,23,24).
What are the key properties of N-(furan-2-ylmethyl)-2-[2-(3-methoxyphenyl)ethylamino]pyridine-4-carboxamide?
N-(furan-2-ylmethyl)-2-[2-(3-methoxyphenyl)ethylamino]pyridine-4-carboxamide has a molecular weight of 351.41 g/mol, XLogP of 3.27, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-2-[2-(3-methoxyphenyl)ethylamino]pyridine-4-carboxamide is sourced from PubChem (CID 109169233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).