2-(4-methoxyphenyl)-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)acetamide

C19H21N5O2 — CID 134798208

IUPAC2-(4-methoxyphenyl)-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)acetamide
SMILESCOc1ccc(CC(=O)NC2CCN(c3ccnc4ccnn34)C2)cc1
InChIInChI=1S/C19H21N5O2/c1-26-16-4-2-14(3-5-16)12-18(25)22-15-8-11-23(13-15)19-7-9-20-17-6-10-21-24(17)19/h2-7,9-10,15H,8,11-13H2,1H3,(H,22,25)
InChIKeyCWAMDASWQMTUSF-UHFFFAOYSA-N
MW351.41 g/mol
LogP1.68
Rot. Bonds5

About 2-(4-methoxyphenyl)-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)acetamide

2-(4-methoxyphenyl)-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)acetamide (PubChem CID 134798208) has the molecular formula C19H21N5O2 and a molecular weight of 351.41 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)acetamide.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)acetamide
PubChem CID134798208
Molecular FormulaC19H21N5O2
Molecular Weight351.41 g/mol
Exact Mass351.17
IUPAC Name2-(4-methoxyphenyl)-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)acetamide
SMILESCOc1ccc(CC(=O)NC2CCN(c3ccnc4ccnn34)C2)cc1
InChIInChI=1S/C19H21N5O2/c1-26-16-4-2-14(3-5-16)12-18(25)22-15-8-11-23(13-15)19-7-9-20-17-6-10-21-24(17)19/h2-7,9-10,15H,8,11-13H2,1H3,(H,22,25)
InChIKeyCWAMDASWQMTUSF-UHFFFAOYSA-N
XLogP1.68
TPSA71.76 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(4-methoxyphenyl)-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidin-3-yl)acetamide
CID 134799199
N-[1-(7-chloroquinolin-4-yl)pyrrolidin-3-yl]-2-(4-methoxyphenyl)acetamide;2,2,2-trifluoroacetic acid
CID 44526011
2,2-dimethyl-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylazetidin-3-yl)propanamide
CID 134796895
N-[(4-methoxyphenyl)methyl]pyrazolo[1,5-a]pyrimidine-7-carboxamide
CID 110851660
N-cycloheptyl-1-pyrazolo[1,5-a]pyrimidin-7-ylazetidine-3-carboxamide
CID 134795993
2-(4-methoxyphenyl)-N-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl)acetamide
CID 112533085
N-[1-[4-chloro-1-[(4-methoxyphenyl)methyl]pyrazolo[3,4-b]pyridin-3-yl]pyrrolidin-3-yl]acetamide
CID 135205014
2-(4-methoxyphenyl)-N-[1-(2-phenylacetyl)piperidin-4-yl]acetamide
CID 108549864
2-(4-aminophenyl)-N-[1-[(3,5-dimethoxyphenyl)methyl]pyrrolidin-3-yl]acetamide;dihydrochloride
CID 119897115
N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidin-4-yl]-2-(4-methoxyphenyl)acetamide
CID 108559543
N-[2-(4-chlorophenyl)ethyl]-1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidine-4-carboxamide
CID 134799593
N-[(3R)-1-(5-methyl-3-pyridinyl)pyrrolidin-3-yl]-2-[4-(2,2,2-trifluoroethoxy)phenyl]acetamide
CID 165019445

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)acetamide?
The IUPAC name of 2-(4-methoxyphenyl)-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)acetamide (CID 134798208) is 2-(4-methoxyphenyl)-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)acetamide.
What is the SMILES notation for 2-(4-methoxyphenyl)-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)acetamide?
The canonical SMILES for 2-(4-methoxyphenyl)-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)acetamide is COc1ccc(CC(=O)NC2CCN(c3ccnc4ccnn34)C2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)acetamide?
The InChIKey is CWAMDASWQMTUSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O2/c1-26-16-4-2-14(3-5-16)12-18(25)22-15-8-11-23(13-15)19-7-9-20-17-6-10-21-24(17)19/h2-7,9-10,15H,8,11-13H2,1H3,(H,22,25).
What are the key properties of 2-(4-methoxyphenyl)-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)acetamide?
2-(4-methoxyphenyl)-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)acetamide has a molecular weight of 351.41 g/mol, XLogP of 1.68, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpyrrolidin-3-yl)acetamide is sourced from PubChem (CID 134798208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).