(4-aminopiperidin-1-yl)-(1-phenylpyrazol-4-yl)methanone

C15H18N4O — CID 28742248

IUPAC(4-aminopiperidin-1-yl)-(1-phenylpyrazol-4-yl)methanone
SMILESNC1CCN(C(=O)c2cnn(-c3ccccc3)c2)CC1
InChIInChI=1S/C15H18N4O/c16-13-6-8-18(9-7-13)15(20)12-10-17-19(11-12)14-4-2-1-3-5-14/h1-5,10-11,13H,6-9,16H2
InChIKeyKVWVBOAVTBQMJM-UHFFFAOYSA-N
MW270.34 g/mol
LogP1.44
Rot. Bonds2

About (4-aminopiperidin-1-yl)-(1-phenylpyrazol-4-yl)methanone

(4-aminopiperidin-1-yl)-(1-phenylpyrazol-4-yl)methanone (PubChem CID 28742248) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is (4-aminopiperidin-1-yl)-(1-phenylpyrazol-4-yl)methanone.

Molecular Properties

Compound Name(4-aminopiperidin-1-yl)-(1-phenylpyrazol-4-yl)methanone
PubChem CID28742248
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC Name(4-aminopiperidin-1-yl)-(1-phenylpyrazol-4-yl)methanone
SMILESNC1CCN(C(=O)c2cnn(-c3ccccc3)c2)CC1
InChIInChI=1S/C15H18N4O/c16-13-6-8-18(9-7-13)15(20)12-10-17-19(11-12)14-4-2-1-3-5-14/h1-5,10-11,13H,6-9,16H2
InChIKeyKVWVBOAVTBQMJM-UHFFFAOYSA-N
XLogP1.44
TPSA64.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

azepan-1-yl-(1-phenylpyrazol-4-yl)methanone
CID 60667576
[3-(chloromethyl)pyrrolidin-1-yl]-(1-phenylpyrazol-4-yl)methanone
CID 63396082
[1-(1-phenylpyrazole-4-carbonyl)pyrrolidin-3-yl]methanesulfonamide
CID 119075063
[(3R)-3-aminopyrrolidin-1-yl]-[1-(3-chlorophenyl)pyrazol-4-yl]methanone
CID 119412281
(3-amino-4-cyclopropylpyrrolidin-1-yl)-(1-phenylpyrazol-4-yl)methanone
CID 156605171
(3-amino-4-methylpyrrolidin-1-yl)-(1-phenylpyrazol-4-yl)methanone
CID 103575963
1,4-diazepan-1-yl-(1-phenylpyrazol-4-yl)methanone
CID 28742263
(4-benzhydrylpiperazin-1-yl)-(1-phenylpyrazol-4-yl)methanone
CID 9041268
1-[1-(3-chlorophenyl)pyrazole-4-carbonyl]piperidine-4-carboxylic acid
CID 154739511
(4-aminopiperidin-1-yl)-(1-phenyltriazol-4-yl)methanone
CID 66485052
[(3R)-3-methylpiperazin-1-yl]-(1-phenylpyrazol-4-yl)methanone
CID 81426790
[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-(1-phenylpyrazol-4-yl)methanone
CID 66260903

Frequently Asked Questions

What is the IUPAC name of (4-aminopiperidin-1-yl)-(1-phenylpyrazol-4-yl)methanone?
The IUPAC name of (4-aminopiperidin-1-yl)-(1-phenylpyrazol-4-yl)methanone (CID 28742248) is (4-aminopiperidin-1-yl)-(1-phenylpyrazol-4-yl)methanone.
What is the SMILES notation for (4-aminopiperidin-1-yl)-(1-phenylpyrazol-4-yl)methanone?
The canonical SMILES for (4-aminopiperidin-1-yl)-(1-phenylpyrazol-4-yl)methanone is NC1CCN(C(=O)c2cnn(-c3ccccc3)c2)CC1.
What is the InChIKey of (4-aminopiperidin-1-yl)-(1-phenylpyrazol-4-yl)methanone?
The InChIKey is KVWVBOAVTBQMJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c16-13-6-8-18(9-7-13)15(20)12-10-17-19(11-12)14-4-2-1-3-5-14/h1-5,10-11,13H,6-9,16H2.
What are the key properties of (4-aminopiperidin-1-yl)-(1-phenylpyrazol-4-yl)methanone?
(4-aminopiperidin-1-yl)-(1-phenylpyrazol-4-yl)methanone has a molecular weight of 270.34 g/mol, XLogP of 1.44, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-aminopiperidin-1-yl)-(1-phenylpyrazol-4-yl)methanone is sourced from PubChem (CID 28742248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).