(4-aminopiperidin-1-yl)-[5-(2-fluorophenyl)-1H-pyrazol-4-yl]methanone

C15H17FN4O — CID 119375415

IUPAC(4-aminopiperidin-1-yl)-[5-(2-fluorophenyl)-1H-pyrazol-4-yl]methanone
SMILESNC1CCN(C(=O)c2cn[nH]c2-c2ccccc2F)CC1
InChIInChI=1S/C15H17FN4O/c16-13-4-2-1-3-11(13)14-12(9-18-19-14)15(21)20-7-5-10(17)6-8-20/h1-4,9-10H,5-8,17H2,(H,18,19)
InChIKeyUHYYDDDQCCSPHL-UHFFFAOYSA-N
MW288.33 g/mol
LogP1.78
Rot. Bonds2

About (4-aminopiperidin-1-yl)-[5-(2-fluorophenyl)-1H-pyrazol-4-yl]methanone

(4-aminopiperidin-1-yl)-[5-(2-fluorophenyl)-1H-pyrazol-4-yl]methanone (PubChem CID 119375415) has the molecular formula C15H17FN4O and a molecular weight of 288.33 g/mol. Its IUPAC name is (4-aminopiperidin-1-yl)-[5-(2-fluorophenyl)-1H-pyrazol-4-yl]methanone.

Molecular Properties

Compound Name(4-aminopiperidin-1-yl)-[5-(2-fluorophenyl)-1H-pyrazol-4-yl]methanone
PubChem CID119375415
Molecular FormulaC15H17FN4O
Molecular Weight288.33 g/mol
Exact Mass288.14
IUPAC Name(4-aminopiperidin-1-yl)-[5-(2-fluorophenyl)-1H-pyrazol-4-yl]methanone
SMILESNC1CCN(C(=O)c2cn[nH]c2-c2ccccc2F)CC1
InChIInChI=1S/C15H17FN4O/c16-13-4-2-1-3-11(13)14-12(9-18-19-14)15(21)20-7-5-10(17)6-8-20/h1-4,9-10H,5-8,17H2,(H,18,19)
InChIKeyUHYYDDDQCCSPHL-UHFFFAOYSA-N
XLogP1.78
TPSA75.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.33
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[5-(2-fluorophenyl)-1H-pyrazol-4-yl]-[4-(methylamino)piperidin-1-yl]methanone
CID 119562475
(4-aminopiperidin-1-yl)-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methanone;hydrochloride
CID 119376653
[(3aR,6aS)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl]-[5-(2-fluorophenyl)-1H-pyrazol-4-yl]methanone
CID 120658572
[5-(2-fluorophenyl)-1H-pyrazol-4-yl]-[3-(methylamino)piperidin-1-yl]methanone;hydrochloride
CID 119491506
[(3R)-3-(1,3-dioxolan-2-yl)piperidin-1-yl]-[5-(2-fluorophenyl)-1H-pyrazol-4-yl]methanone
CID 97051192
5-(2-fluorophenyl)-1H-pyrazole-4-carboxamide
CID 171539156
(4-aminopiperidin-1-yl)-[5-(3-chlorophenyl)-1H-pyrazol-4-yl]methanone
CID 119375417
2-[5-(2-fluorophenyl)-1H-pyrazole-4-carbonyl]-1,3,4,7,8,9a-hexahydropyrazino[1,2-a]pyrazine-6,9-dione
CID 50973625
[5-(2-fluorophenyl)-1H-pyrazol-4-yl]-[(1S,5R)-3-methyl-3,6-diazabicyclo[3.2.2]nonan-6-yl]methanone
CID 74235659
(3S)-1-[5-(2,6-difluorophenyl)-1H-pyrazole-4-carbonyl]pyrrolidine-3-carboxylic acid
CID 124610704
(4-aminopiperidin-1-yl)-[5-(3-methoxyphenyl)-1H-pyrazol-4-yl]methanone
CID 139023916
[4-(3-aminopropoxy)piperidin-1-yl]-[5-(2-chlorophenyl)-1H-pyrazol-4-yl]methanone
CID 119664349

Frequently Asked Questions

What is the IUPAC name of (4-aminopiperidin-1-yl)-[5-(2-fluorophenyl)-1H-pyrazol-4-yl]methanone?
The IUPAC name of (4-aminopiperidin-1-yl)-[5-(2-fluorophenyl)-1H-pyrazol-4-yl]methanone (CID 119375415) is (4-aminopiperidin-1-yl)-[5-(2-fluorophenyl)-1H-pyrazol-4-yl]methanone.
What is the SMILES notation for (4-aminopiperidin-1-yl)-[5-(2-fluorophenyl)-1H-pyrazol-4-yl]methanone?
The canonical SMILES for (4-aminopiperidin-1-yl)-[5-(2-fluorophenyl)-1H-pyrazol-4-yl]methanone is NC1CCN(C(=O)c2cn[nH]c2-c2ccccc2F)CC1.
What is the InChIKey of (4-aminopiperidin-1-yl)-[5-(2-fluorophenyl)-1H-pyrazol-4-yl]methanone?
The InChIKey is UHYYDDDQCCSPHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN4O/c16-13-4-2-1-3-11(13)14-12(9-18-19-14)15(21)20-7-5-10(17)6-8-20/h1-4,9-10H,5-8,17H2,(H,18,19).
What are the key properties of (4-aminopiperidin-1-yl)-[5-(2-fluorophenyl)-1H-pyrazol-4-yl]methanone?
(4-aminopiperidin-1-yl)-[5-(2-fluorophenyl)-1H-pyrazol-4-yl]methanone has a molecular weight of 288.33 g/mol, XLogP of 1.78, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-aminopiperidin-1-yl)-[5-(2-fluorophenyl)-1H-pyrazol-4-yl]methanone is sourced from PubChem (CID 119375415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).