N-(1-benzylpyrrolidin-3-yl)-2-(3-pyrazol-1-ylazetidin-1-yl)acetamide

C19H25N5O — CID 56781183

IUPACN-(1-benzylpyrrolidin-3-yl)-2-(3-pyrazol-1-ylazetidin-1-yl)acetamide
SMILESO=C(CN1CC(n2cccn2)C1)NC1CCN(Cc2ccccc2)C1
InChIInChI=1S/C19H25N5O/c25-19(15-23-13-18(14-23)24-9-4-8-20-24)21-17-7-10-22(12-17)11-16-5-2-1-3-6-16/h1-6,8-9,17-18H,7,10-15H2,(H,21,25)
InChIKeyFZGUTPACWPNSPN-UHFFFAOYSA-N
MW339.44 g/mol
LogP1.13
Rot. Bonds6

About N-(1-benzylpyrrolidin-3-yl)-2-(3-pyrazol-1-ylazetidin-1-yl)acetamide

N-(1-benzylpyrrolidin-3-yl)-2-(3-pyrazol-1-ylazetidin-1-yl)acetamide (PubChem CID 56781183) has the molecular formula C19H25N5O and a molecular weight of 339.44 g/mol. Its IUPAC name is N-(1-benzylpyrrolidin-3-yl)-2-(3-pyrazol-1-ylazetidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(1-benzylpyrrolidin-3-yl)-2-(3-pyrazol-1-ylazetidin-1-yl)acetamide
PubChem CID56781183
Molecular FormulaC19H25N5O
Molecular Weight339.44 g/mol
Exact Mass339.21
IUPAC NameN-(1-benzylpyrrolidin-3-yl)-2-(3-pyrazol-1-ylazetidin-1-yl)acetamide
SMILESO=C(CN1CC(n2cccn2)C1)NC1CCN(Cc2ccccc2)C1
InChIInChI=1S/C19H25N5O/c25-19(15-23-13-18(14-23)24-9-4-8-20-24)21-17-7-10-22(12-17)11-16-5-2-1-3-6-16/h1-6,8-9,17-18H,7,10-15H2,(H,21,25)
InChIKeyFZGUTPACWPNSPN-UHFFFAOYSA-N
XLogP1.13
TPSA53.40 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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CID 93027730
N-(1-benzylpiperidin-4-yl)-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]acetamide
CID 8542398
N-[(3R)-1-benzylpyrrolidin-3-yl]-4-phenylbutanamide
CID 51947538
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CID 62833579
N-[(3R)-1-benzylpyrrolidin-3-yl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
CID 9488591
2-(azetidin-3-yl)-N-(1-benzylpyrrolidin-3-yl)acetamide
CID 64618361
N-[(3R)-1-benzylpyrrolidin-3-yl]-2-(3-fluorophenyl)acetamide
CID 39959483
N-(1-benzylpyrrolidin-3-yl)-2-(3-ethyl-2-oxobenzimidazol-1-yl)acetamide
CID 18156454
2-[(4aS,8aS)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-N-(1-benzylpiperidin-4-yl)acetamide
CID 11932070
1-(1-benzylpyrrolidin-3-yl)-3-(2,6-dimethylphenyl)urea
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Frequently Asked Questions

What is the IUPAC name of N-(1-benzylpyrrolidin-3-yl)-2-(3-pyrazol-1-ylazetidin-1-yl)acetamide?
The IUPAC name of N-(1-benzylpyrrolidin-3-yl)-2-(3-pyrazol-1-ylazetidin-1-yl)acetamide (CID 56781183) is N-(1-benzylpyrrolidin-3-yl)-2-(3-pyrazol-1-ylazetidin-1-yl)acetamide.
What is the SMILES notation for N-(1-benzylpyrrolidin-3-yl)-2-(3-pyrazol-1-ylazetidin-1-yl)acetamide?
The canonical SMILES for N-(1-benzylpyrrolidin-3-yl)-2-(3-pyrazol-1-ylazetidin-1-yl)acetamide is O=C(CN1CC(n2cccn2)C1)NC1CCN(Cc2ccccc2)C1.
What is the InChIKey of N-(1-benzylpyrrolidin-3-yl)-2-(3-pyrazol-1-ylazetidin-1-yl)acetamide?
The InChIKey is FZGUTPACWPNSPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O/c25-19(15-23-13-18(14-23)24-9-4-8-20-24)21-17-7-10-22(12-17)11-16-5-2-1-3-6-16/h1-6,8-9,17-18H,7,10-15H2,(H,21,25).
What are the key properties of N-(1-benzylpyrrolidin-3-yl)-2-(3-pyrazol-1-ylazetidin-1-yl)acetamide?
N-(1-benzylpyrrolidin-3-yl)-2-(3-pyrazol-1-ylazetidin-1-yl)acetamide has a molecular weight of 339.44 g/mol, XLogP of 1.13, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzylpyrrolidin-3-yl)-2-(3-pyrazol-1-ylazetidin-1-yl)acetamide is sourced from PubChem (CID 56781183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).