N-(5-cyclopentyl-1H-pyrazol-3-yl)-2-(1,3-dihydroisoindol-2-yl)acetamide

C18H22N4O — CID 75362957

IUPACN-(5-cyclopentyl-1H-pyrazol-3-yl)-2-(1,3-dihydroisoindol-2-yl)acetamide
SMILESO=C(CN1Cc2ccccc2C1)Nc1cc(C2CCCC2)[nH]n1
InChIInChI=1S/C18H22N4O/c23-18(12-22-10-14-7-3-4-8-15(14)11-22)19-17-9-16(20-21-17)13-5-1-2-6-13/h3-4,7-9,13H,1-2,5-6,10-12H2,(H2,19,20,21,23)
InChIKeyYCNROWBYLJCMQO-UHFFFAOYSA-N
MW310.40 g/mol
LogP3.02
Rot. Bonds4

About N-(5-cyclopentyl-1H-pyrazol-3-yl)-2-(1,3-dihydroisoindol-2-yl)acetamide

N-(5-cyclopentyl-1H-pyrazol-3-yl)-2-(1,3-dihydroisoindol-2-yl)acetamide (PubChem CID 75362957) has the molecular formula C18H22N4O and a molecular weight of 310.40 g/mol. Its IUPAC name is N-(5-cyclopentyl-1H-pyrazol-3-yl)-2-(1,3-dihydroisoindol-2-yl)acetamide.

Molecular Properties

Compound NameN-(5-cyclopentyl-1H-pyrazol-3-yl)-2-(1,3-dihydroisoindol-2-yl)acetamide
PubChem CID75362957
Molecular FormulaC18H22N4O
Molecular Weight310.40 g/mol
Exact Mass310.18
IUPAC NameN-(5-cyclopentyl-1H-pyrazol-3-yl)-2-(1,3-dihydroisoindol-2-yl)acetamide
SMILESO=C(CN1Cc2ccccc2C1)Nc1cc(C2CCCC2)[nH]n1
InChIInChI=1S/C18H22N4O/c23-18(12-22-10-14-7-3-4-8-15(14)11-22)19-17-9-16(20-21-17)13-5-1-2-6-13/h3-4,7-9,13H,1-2,5-6,10-12H2,(H2,19,20,21,23)
InChIKeyYCNROWBYLJCMQO-UHFFFAOYSA-N
XLogP3.02
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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2-[4-(2-acetylphenyl)phenyl]-N-(5-cyclopropyl-1H-pyrazol-3-yl)acetamide
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2-(3-aminonaphthalen-2-yl)-N-(5-cyclopropyl-1H-pyrazol-3-yl)acetamide
CID 22176805
N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-(4-phenoxyphenyl)acetamide
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Frequently Asked Questions

What is the IUPAC name of N-(5-cyclopentyl-1H-pyrazol-3-yl)-2-(1,3-dihydroisoindol-2-yl)acetamide?
The IUPAC name of N-(5-cyclopentyl-1H-pyrazol-3-yl)-2-(1,3-dihydroisoindol-2-yl)acetamide (CID 75362957) is N-(5-cyclopentyl-1H-pyrazol-3-yl)-2-(1,3-dihydroisoindol-2-yl)acetamide.
What is the SMILES notation for N-(5-cyclopentyl-1H-pyrazol-3-yl)-2-(1,3-dihydroisoindol-2-yl)acetamide?
The canonical SMILES for N-(5-cyclopentyl-1H-pyrazol-3-yl)-2-(1,3-dihydroisoindol-2-yl)acetamide is O=C(CN1Cc2ccccc2C1)Nc1cc(C2CCCC2)[nH]n1.
What is the InChIKey of N-(5-cyclopentyl-1H-pyrazol-3-yl)-2-(1,3-dihydroisoindol-2-yl)acetamide?
The InChIKey is YCNROWBYLJCMQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4O/c23-18(12-22-10-14-7-3-4-8-15(14)11-22)19-17-9-16(20-21-17)13-5-1-2-6-13/h3-4,7-9,13H,1-2,5-6,10-12H2,(H2,19,20,21,23).
What are the key properties of N-(5-cyclopentyl-1H-pyrazol-3-yl)-2-(1,3-dihydroisoindol-2-yl)acetamide?
N-(5-cyclopentyl-1H-pyrazol-3-yl)-2-(1,3-dihydroisoindol-2-yl)acetamide has a molecular weight of 310.40 g/mol, XLogP of 3.02, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyclopentyl-1H-pyrazol-3-yl)-2-(1,3-dihydroisoindol-2-yl)acetamide is sourced from PubChem (CID 75362957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).