2-methoxy-N-[4-[(2-methylpyrazol-3-yl)methylamino]phenyl]acetamide

C14H18N4O2 — CID 43717460

IUPAC2-methoxy-N-[4-[(2-methylpyrazol-3-yl)methylamino]phenyl]acetamide
SMILESCOCC(=O)Nc1ccc(NCc2ccnn2C)cc1
InChIInChI=1S/C14H18N4O2/c1-18-13(7-8-16-18)9-15-11-3-5-12(6-4-11)17-14(19)10-20-2/h3-8,15H,9-10H2,1-2H3,(H,17,19)
InChIKeyDSJYGCAHZZETCX-UHFFFAOYSA-N
MW274.32 g/mol
LogP1.62
Rot. Bonds6

About 2-methoxy-N-[4-[(2-methylpyrazol-3-yl)methylamino]phenyl]acetamide

2-methoxy-N-[4-[(2-methylpyrazol-3-yl)methylamino]phenyl]acetamide (PubChem CID 43717460) has the molecular formula C14H18N4O2 and a molecular weight of 274.32 g/mol. Its IUPAC name is 2-methoxy-N-[4-[(2-methylpyrazol-3-yl)methylamino]phenyl]acetamide.

Molecular Properties

Compound Name2-methoxy-N-[4-[(2-methylpyrazol-3-yl)methylamino]phenyl]acetamide
PubChem CID43717460
Molecular FormulaC14H18N4O2
Molecular Weight274.32 g/mol
Exact Mass274.14
IUPAC Name2-methoxy-N-[4-[(2-methylpyrazol-3-yl)methylamino]phenyl]acetamide
SMILESCOCC(=O)Nc1ccc(NCc2ccnn2C)cc1
InChIInChI=1S/C14H18N4O2/c1-18-13(7-8-16-18)9-15-11-3-5-12(6-4-11)17-14(19)10-20-2/h3-8,15H,9-10H2,1-2H3,(H,17,19)
InChIKeyDSJYGCAHZZETCX-UHFFFAOYSA-N
XLogP1.62
TPSA68.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-[(2-ethylpyrazol-3-yl)methylamino]phenyl]-2-methoxyacetamide
CID 115761980
2-methoxy-N-(2-methylpyrazol-3-yl)acetamide
CID 110470519
2-methoxy-N-[4-(pyrimidin-5-ylmethylamino)phenyl]acetamide
CID 62760279
N-[(2-methylpyrazol-3-yl)methyl]pyridin-4-amine
CID 63302069
N-[4-[(4-hydroxyphenyl)methylamino]phenyl]-2-methoxyacetamide
CID 43717389
N-[4-[(5-ethylthiophen-2-yl)methylamino]phenyl]-2-methoxyacetamide
CID 62345367
3,4-dimethoxy-N-[(2-methylpyrazol-3-yl)methyl]aniline
CID 19619255
2-methoxy-5-[(2-methylpyrazol-3-yl)methylamino]phenol
CID 43743858
2-hydroxy-4-[(2-methylpyrazol-3-yl)methylamino]benzoic acid
CID 19624610
1-methyl-5-[(2-methylpyrazol-3-yl)methylamino]pyridin-2-one
CID 60930659
N-[4-[(2-chlorophenyl)methylamino]phenyl]-2-methoxyacetamide
CID 43717390
4-chloro-N-[4-[(2-methoxyacetyl)amino]phenyl]-1-methylpyrazole-5-carboxamide
CID 131940972

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[4-[(2-methylpyrazol-3-yl)methylamino]phenyl]acetamide?
The IUPAC name of 2-methoxy-N-[4-[(2-methylpyrazol-3-yl)methylamino]phenyl]acetamide (CID 43717460) is 2-methoxy-N-[4-[(2-methylpyrazol-3-yl)methylamino]phenyl]acetamide.
What is the SMILES notation for 2-methoxy-N-[4-[(2-methylpyrazol-3-yl)methylamino]phenyl]acetamide?
The canonical SMILES for 2-methoxy-N-[4-[(2-methylpyrazol-3-yl)methylamino]phenyl]acetamide is COCC(=O)Nc1ccc(NCc2ccnn2C)cc1.
What is the InChIKey of 2-methoxy-N-[4-[(2-methylpyrazol-3-yl)methylamino]phenyl]acetamide?
The InChIKey is DSJYGCAHZZETCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2/c1-18-13(7-8-16-18)9-15-11-3-5-12(6-4-11)17-14(19)10-20-2/h3-8,15H,9-10H2,1-2H3,(H,17,19).
What are the key properties of 2-methoxy-N-[4-[(2-methylpyrazol-3-yl)methylamino]phenyl]acetamide?
2-methoxy-N-[4-[(2-methylpyrazol-3-yl)methylamino]phenyl]acetamide has a molecular weight of 274.32 g/mol, XLogP of 1.62, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[4-[(2-methylpyrazol-3-yl)methylamino]phenyl]acetamide is sourced from PubChem (CID 43717460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).