azetidin-1-yl(1H-pyrazol-4-yl)methanone

C7H9N3O — CID 130157927

IUPACazetidin-1-yl(1H-pyrazol-4-yl)methanone
SMILESO=C(c1cn[nH]c1)N1CCC1
InChIInChI=1S/C7H9N3O/c11-7(10-2-1-3-10)6-4-8-9-5-6/h4-5H,1-3H2,(H,8,9)
InChIKeyZFEIVWNOBYANPO-UHFFFAOYSA-N
MW151.17 g/mol
LogP0.26
Rot. Bonds1

About azetidin-1-yl(1H-pyrazol-4-yl)methanone

azetidin-1-yl(1H-pyrazol-4-yl)methanone (PubChem CID 130157927) has the molecular formula C7H9N3O and a molecular weight of 151.17 g/mol. Its IUPAC name is azetidin-1-yl(1H-pyrazol-4-yl)methanone.

Molecular Properties

Compound Nameazetidin-1-yl(1H-pyrazol-4-yl)methanone
PubChem CID130157927
Molecular FormulaC7H9N3O
Molecular Weight151.17 g/mol
Exact Mass151.07
IUPAC Nameazetidin-1-yl(1H-pyrazol-4-yl)methanone
SMILESO=C(c1cn[nH]c1)N1CCC1
InChIInChI=1S/C7H9N3O/c11-7(10-2-1-3-10)6-4-8-9-5-6/h4-5H,1-3H2,(H,8,9)
InChIKeyZFEIVWNOBYANPO-UHFFFAOYSA-N
XLogP0.26
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.17
LogP ≤ 50.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[4-(2-bromoethyl)-1,4-diazepan-1-yl]-(1H-pyrazol-4-yl)methanone
CID 80665317
(4-chloropiperidin-1-yl)-(1H-pyrazol-4-yl)methanone
CID 63390634
(3-chloro-5-methoxyphenyl)-[4-(1H-pyrazole-4-carbonyl)-1,4-diazepan-1-yl]methanone
CID 134708918
[4-(hydroxymethyl)piperidin-1-yl]-(1H-pyrazol-4-yl)methanone
CID 43582926
[4-(2-bromoethyl)piperazin-1-yl]-(1H-pyrazol-4-yl)methanone
CID 80660526
(4-propylpiperazin-1-yl)-(1H-pyrazol-4-yl)methanone
CID 43582709
1,4-dioxa-8-azaspiro[4.5]decan-8-yl(1H-pyrazol-4-yl)methanone
CID 110853513
1-(1H-pyrazole-4-carbonyl)-1,4-diazepan-5-one
CID 62045064
1H-pyrazol-4-yl-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]methanone
CID 54877453
3-methyl-1-(1H-pyrazole-4-carbonyl)piperidine-3-carboxylic acid
CID 63134382
[3-(bromomethyl)piperidin-1-yl]-(1H-pyrazol-4-yl)methanone
CID 80660595
[3-(dimethylamino)piperidin-1-yl]-(1H-pyrazol-4-yl)methanone
CID 63616448

Frequently Asked Questions

What is the IUPAC name of azetidin-1-yl(1H-pyrazol-4-yl)methanone?
The IUPAC name of azetidin-1-yl(1H-pyrazol-4-yl)methanone (CID 130157927) is azetidin-1-yl(1H-pyrazol-4-yl)methanone.
What is the SMILES notation for azetidin-1-yl(1H-pyrazol-4-yl)methanone?
The canonical SMILES for azetidin-1-yl(1H-pyrazol-4-yl)methanone is O=C(c1cn[nH]c1)N1CCC1.
What is the InChIKey of azetidin-1-yl(1H-pyrazol-4-yl)methanone?
The InChIKey is ZFEIVWNOBYANPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O/c11-7(10-2-1-3-10)6-4-8-9-5-6/h4-5H,1-3H2,(H,8,9).
What are the key properties of azetidin-1-yl(1H-pyrazol-4-yl)methanone?
azetidin-1-yl(1H-pyrazol-4-yl)methanone has a molecular weight of 151.17 g/mol, XLogP of 0.26, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for azetidin-1-yl(1H-pyrazol-4-yl)methanone is sourced from PubChem (CID 130157927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).