N-[[6-(5-chloro-2-methoxyphenyl)-3-pyridinyl]methyl]acetamide

C15H15ClN2O2 — CID 74243787

IUPACN-[[6-(5-chloro-2-methoxyphenyl)-3-pyridinyl]methyl]acetamide
SMILESCOc1ccc(Cl)cc1-c1ccc(CNC(C)=O)cn1
InChIInChI=1S/C15H15ClN2O2/c1-10(19)17-8-11-3-5-14(18-9-11)13-7-12(16)4-6-15(13)20-2/h3-7,9H,8H2,1-2H3,(H,17,19)
InChIKeyHAQGHYRPNPHJNP-UHFFFAOYSA-N
MW290.75 g/mol
LogP3.05
Rot. Bonds4

About N-[[6-(5-chloro-2-methoxyphenyl)-3-pyridinyl]methyl]acetamide

N-[[6-(5-chloro-2-methoxyphenyl)-3-pyridinyl]methyl]acetamide (PubChem CID 74243787) has the molecular formula C15H15ClN2O2 and a molecular weight of 290.75 g/mol. Its IUPAC name is N-[[6-(5-chloro-2-methoxyphenyl)-3-pyridinyl]methyl]acetamide.

Molecular Properties

Compound NameN-[[6-(5-chloro-2-methoxyphenyl)-3-pyridinyl]methyl]acetamide
PubChem CID74243787
Molecular FormulaC15H15ClN2O2
Molecular Weight290.75 g/mol
Exact Mass290.08
IUPAC NameN-[[6-(5-chloro-2-methoxyphenyl)-3-pyridinyl]methyl]acetamide
SMILESCOc1ccc(Cl)cc1-c1ccc(CNC(C)=O)cn1
InChIInChI=1S/C15H15ClN2O2/c1-10(19)17-8-11-3-5-14(18-9-11)13-7-12(16)4-6-15(13)20-2/h3-7,9H,8H2,1-2H3,(H,17,19)
InChIKeyHAQGHYRPNPHJNP-UHFFFAOYSA-N
XLogP3.05
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.75
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[6-(4-methoxy-2-methylphenyl)-3-pyridinyl]methyl]acetamide
CID 50969946
N-[(6-phenyl-3-pyridinyl)methyl]acetamide
CID 143102890
5-chloro-2-methoxy-N-[(4-methylphenyl)methyl]benzamide
CID 2671578
5-chloro-2-methoxy-N-[(4-propan-2-ylphenyl)methyl]benzamide
CID 71822169
5-chloro-2-methoxy-N-[(6-methyl-3-pyridinyl)methyl]aniline
CID 104756549
2-(2,4-dichlorophenyl)-N-[(6-methoxy-3-pyridinyl)methyl]acetamide
CID 51303949
N-[(3-amino-4-methoxyphenyl)methyl]-5-chloro-2-methylbenzamide
CID 82877628
N-[[4-[2-[(5-chloro-2-methoxyphenyl)sulfonylamino]-1,3-thiazol-4-yl]phenyl]methyl]acetamide
CID 108782675
[(2R)-1-[(4-methoxyphenyl)methylamino]-1-oxopropan-2-yl] 5-chloro-2-methoxybenzoate
CID 7291407
[(2R)-1-[(4-fluorophenyl)methylamino]-1-oxopropan-2-yl] 5-chloro-2-methoxybenzoate
CID 8738446
N-(5-chloro-2-methoxyphenyl)-5-[(4-fluorophenyl)methylamino]pyridine-2-carboxamide
CID 109189781
ethyl 2-[4-[[(5-chloro-2-methoxybenzoyl)amino]methyl]phenoxy]acetate
CID 154145410

Frequently Asked Questions

What is the IUPAC name of N-[[6-(5-chloro-2-methoxyphenyl)-3-pyridinyl]methyl]acetamide?
The IUPAC name of N-[[6-(5-chloro-2-methoxyphenyl)-3-pyridinyl]methyl]acetamide (CID 74243787) is N-[[6-(5-chloro-2-methoxyphenyl)-3-pyridinyl]methyl]acetamide.
What is the SMILES notation for N-[[6-(5-chloro-2-methoxyphenyl)-3-pyridinyl]methyl]acetamide?
The canonical SMILES for N-[[6-(5-chloro-2-methoxyphenyl)-3-pyridinyl]methyl]acetamide is COc1ccc(Cl)cc1-c1ccc(CNC(C)=O)cn1.
What is the InChIKey of N-[[6-(5-chloro-2-methoxyphenyl)-3-pyridinyl]methyl]acetamide?
The InChIKey is HAQGHYRPNPHJNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O2/c1-10(19)17-8-11-3-5-14(18-9-11)13-7-12(16)4-6-15(13)20-2/h3-7,9H,8H2,1-2H3,(H,17,19).
What are the key properties of N-[[6-(5-chloro-2-methoxyphenyl)-3-pyridinyl]methyl]acetamide?
N-[[6-(5-chloro-2-methoxyphenyl)-3-pyridinyl]methyl]acetamide has a molecular weight of 290.75 g/mol, XLogP of 3.05, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-(5-chloro-2-methoxyphenyl)-3-pyridinyl]methyl]acetamide is sourced from PubChem (CID 74243787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).