2-(cyclopropylmethoxy)-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]acetamide

C16H19N3O3 — CID 51099259

IUPAC2-(cyclopropylmethoxy)-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]acetamide
SMILESCOc1ccccc1-c1cc(NC(=O)COCC2CC2)n[nH]1
InChIInChI=1S/C16H19N3O3/c1-21-14-5-3-2-4-12(14)13-8-15(19-18-13)17-16(20)10-22-9-11-6-7-11/h2-5,8,11H,6-7,9-10H2,1H3,(H2,17,18,19,20)
InChIKeyVUCVMWQWAFECKI-UHFFFAOYSA-N
MW301.35 g/mol
LogP2.45
Rot. Bonds7

About 2-(cyclopropylmethoxy)-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]acetamide

2-(cyclopropylmethoxy)-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]acetamide (PubChem CID 51099259) has the molecular formula C16H19N3O3 and a molecular weight of 301.35 g/mol. Its IUPAC name is 2-(cyclopropylmethoxy)-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]acetamide.

Molecular Properties

Compound Name2-(cyclopropylmethoxy)-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]acetamide
PubChem CID51099259
Molecular FormulaC16H19N3O3
Molecular Weight301.35 g/mol
Exact Mass301.14
IUPAC Name2-(cyclopropylmethoxy)-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]acetamide
SMILESCOc1ccccc1-c1cc(NC(=O)COCC2CC2)n[nH]1
InChIInChI=1S/C16H19N3O3/c1-21-14-5-3-2-4-12(14)13-8-15(19-18-13)17-16(20)10-22-9-11-6-7-11/h2-5,8,11H,6-7,9-10H2,1H3,(H2,17,18,19,20)
InChIKeyVUCVMWQWAFECKI-UHFFFAOYSA-N
XLogP2.45
TPSA76.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethoxy)-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]acetamide?
The IUPAC name of 2-(cyclopropylmethoxy)-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]acetamide (CID 51099259) is 2-(cyclopropylmethoxy)-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]acetamide.
What is the SMILES notation for 2-(cyclopropylmethoxy)-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]acetamide?
The canonical SMILES for 2-(cyclopropylmethoxy)-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]acetamide is COc1ccccc1-c1cc(NC(=O)COCC2CC2)n[nH]1.
What is the InChIKey of 2-(cyclopropylmethoxy)-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]acetamide?
The InChIKey is VUCVMWQWAFECKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O3/c1-21-14-5-3-2-4-12(14)13-8-15(19-18-13)17-16(20)10-22-9-11-6-7-11/h2-5,8,11H,6-7,9-10H2,1H3,(H2,17,18,19,20).
What are the key properties of 2-(cyclopropylmethoxy)-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]acetamide?
2-(cyclopropylmethoxy)-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]acetamide has a molecular weight of 301.35 g/mol, XLogP of 2.45, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethoxy)-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]acetamide is sourced from PubChem (CID 51099259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).