N-[2-(3-methoxyphenyl)ethyl]-2-(1-phenylethylamino)pyridine-4-carboxamide

C23H25N3O2 — CID 109170133

IUPACN-[2-(3-methoxyphenyl)ethyl]-2-(1-phenylethylamino)pyridine-4-carboxamide
SMILESCOc1cccc(CCNC(=O)c2ccnc(NC(C)c3ccccc3)c2)c1
InChIInChI=1S/C23H25N3O2/c1-17(19-8-4-3-5-9-19)26-22-16-20(12-14-24-22)23(27)25-13-11-18-7-6-10-21(15-18)28-2/h3-10,12,14-17H,11,13H2,1-2H3,(H,24,26)(H,25,27)
InChIKeyMELDMPAHBZVMHM-UHFFFAOYSA-N
MW375.47 g/mol
LogP4.24
Rot. Bonds8

About N-[2-(3-methoxyphenyl)ethyl]-2-(1-phenylethylamino)pyridine-4-carboxamide

N-[2-(3-methoxyphenyl)ethyl]-2-(1-phenylethylamino)pyridine-4-carboxamide (PubChem CID 109170133) has the molecular formula C23H25N3O2 and a molecular weight of 375.47 g/mol. Its IUPAC name is N-[2-(3-methoxyphenyl)ethyl]-2-(1-phenylethylamino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[2-(3-methoxyphenyl)ethyl]-2-(1-phenylethylamino)pyridine-4-carboxamide
PubChem CID109170133
Molecular FormulaC23H25N3O2
Molecular Weight375.47 g/mol
Exact Mass375.19
IUPAC NameN-[2-(3-methoxyphenyl)ethyl]-2-(1-phenylethylamino)pyridine-4-carboxamide
SMILESCOc1cccc(CCNC(=O)c2ccnc(NC(C)c3ccccc3)c2)c1
InChIInChI=1S/C23H25N3O2/c1-17(19-8-4-3-5-9-19)26-22-16-20(12-14-24-22)23(27)25-13-11-18-7-6-10-21(15-18)28-2/h3-10,12,14-17H,11,13H2,1-2H3,(H,24,26)(H,25,27)
InChIKeyMELDMPAHBZVMHM-UHFFFAOYSA-N
XLogP4.24
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.47
LogP ≤ 54.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(benzylamino)-N-[2-(3-methoxyphenyl)ethyl]pyridine-4-carboxamide
CID 109169514
2-(cyclopropylamino)-N-[2-(3-methoxyphenyl)ethyl]pyridine-4-carboxamide
CID 109165237
2-[2-(3-methoxyphenyl)ethylamino]-N-propylpyridine-4-carboxamide
CID 109165037
N-[2-(3-methoxyphenyl)ethyl]-6-methyl-2-(1-phenylethylamino)pyrimidine-4-carboxamide
CID 109328008
4-N-[2-(3-methoxyphenyl)ethyl]-2-N-methyl-2-N-phenylpyridine-2,4-dicarboxamide
CID 109088154
2-N-[2-(3-methoxyphenyl)ethyl]-4-N-phenylpyridine-2,4-dicarboxamide
CID 109088169
1-[2-(3-methoxyphenyl)ethyl]-3-(1-phenylethyl)urea
CID 86992683
2-(N-ethylanilino)-N-[2-(3-methoxyphenyl)ethyl]pyridine-4-carboxamide
CID 109172872
1-N-[2-(3-methoxyphenyl)ethyl]-3-N-(3-methylbutyl)benzene-1,3-dicarboxamide
CID 109055482
N-(furan-2-ylmethyl)-2-[2-(3-methoxyphenyl)ethylamino]pyridine-4-carboxamide
CID 109169233
6-(benzylamino)-N-[2-(3-methoxyphenyl)ethyl]pyridine-3-carboxamide
CID 109155485
2-chloro-N-[2-(3-methoxyphenyl)ethyl]-2-phenylacetamide
CID 107851262

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-methoxyphenyl)ethyl]-2-(1-phenylethylamino)pyridine-4-carboxamide?
The IUPAC name of N-[2-(3-methoxyphenyl)ethyl]-2-(1-phenylethylamino)pyridine-4-carboxamide (CID 109170133) is N-[2-(3-methoxyphenyl)ethyl]-2-(1-phenylethylamino)pyridine-4-carboxamide.
What is the SMILES notation for N-[2-(3-methoxyphenyl)ethyl]-2-(1-phenylethylamino)pyridine-4-carboxamide?
The canonical SMILES for N-[2-(3-methoxyphenyl)ethyl]-2-(1-phenylethylamino)pyridine-4-carboxamide is COc1cccc(CCNC(=O)c2ccnc(NC(C)c3ccccc3)c2)c1.
What is the InChIKey of N-[2-(3-methoxyphenyl)ethyl]-2-(1-phenylethylamino)pyridine-4-carboxamide?
The InChIKey is MELDMPAHBZVMHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O2/c1-17(19-8-4-3-5-9-19)26-22-16-20(12-14-24-22)23(27)25-13-11-18-7-6-10-21(15-18)28-2/h3-10,12,14-17H,11,13H2,1-2H3,(H,24,26)(H,25,27).
What are the key properties of N-[2-(3-methoxyphenyl)ethyl]-2-(1-phenylethylamino)pyridine-4-carboxamide?
N-[2-(3-methoxyphenyl)ethyl]-2-(1-phenylethylamino)pyridine-4-carboxamide has a molecular weight of 375.47 g/mol, XLogP of 4.24, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-methoxyphenyl)ethyl]-2-(1-phenylethylamino)pyridine-4-carboxamide is sourced from PubChem (CID 109170133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).