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

C11H16N4O — CID 60959056

IUPAC(4-cyclopropylpiperazin-1-yl)-(1H-pyrazol-4-yl)methanone
SMILESO=C(c1cn[nH]c1)N1CCN(C2CC2)CC1
InChIInChI=1S/C11H16N4O/c16-11(9-7-12-13-8-9)15-5-3-14(4-6-15)10-1-2-10/h7-8,10H,1-6H2,(H,12,13)
InChIKeyPEACURHDZLMBII-UHFFFAOYSA-N
MW220.28 g/mol
LogP0.33
Rot. Bonds2

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

(4-cyclopropylpiperazin-1-yl)-(1H-pyrazol-4-yl)methanone (PubChem CID 60959056) has the molecular formula C11H16N4O and a molecular weight of 220.28 g/mol. Its IUPAC name is (4-cyclopropylpiperazin-1-yl)-(1H-pyrazol-4-yl)methanone.

Molecular Properties

Compound Name(4-cyclopropylpiperazin-1-yl)-(1H-pyrazol-4-yl)methanone
PubChem CID60959056
Molecular FormulaC11H16N4O
Molecular Weight220.28 g/mol
Exact Mass220.13
IUPAC Name(4-cyclopropylpiperazin-1-yl)-(1H-pyrazol-4-yl)methanone
SMILESO=C(c1cn[nH]c1)N1CCN(C2CC2)CC1
InChIInChI=1S/C11H16N4O/c16-11(9-7-12-13-8-9)15-5-3-14(4-6-15)10-1-2-10/h7-8,10H,1-6H2,(H,12,13)
InChIKeyPEACURHDZLMBII-UHFFFAOYSA-N
XLogP0.33
TPSA52.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.28
LogP ≤ 50.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dimethyl-1H-pyrazole-4-carboxamide
CID 13450481
(1H-Pyrazol-4-yl)(pyrrolidin-1-yl)methanone
CID 43582286
1-(1H-pyrazole-4-carbonyl)piperidin-4-amine
CID 43565570
N-methyl-N-(4-morpholin-4-ylbutyl)-1H-pyrazole-4-carboxamide
CID 77092439
N-methyl-N-[[(2R)-1-methylpiperidin-2-yl]methyl]-1H-pyrazole-4-carboxamide
CID 125526617
[(3S)-3-propyl-4-(1H-pyrazole-4-carbonyl)piperazin-1-yl]-(1H-pyrazol-4-yl)methanone
CID 164631489
N-(trifluoromethyl)-N-(1,1,1-trifluoropropan-2-yl)-1H-pyrazole-4-carboxamide
CID 90898393
Morpholino(1H-pyrazol-4-yl)methanone
CID 20784942
N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)-1H-pyrazole-4-carboxamide
CID 43603369
N-pentan-3-yl-N-(2,2,2-trifluoroethyl)-1H-pyrazole-4-carboxamide
CID 54876830
N-[2-(dimethylamino)-2-oxoethyl]-N-(2,2,2-trifluoroethyl)-1H-pyrazole-4-carboxamide
CID 54876866
N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)-1H-pyrazole-4-carboxamide
CID 54877025

Frequently Asked Questions

What is the IUPAC name of (4-cyclopropylpiperazin-1-yl)-(1H-pyrazol-4-yl)methanone?
The IUPAC name of (4-cyclopropylpiperazin-1-yl)-(1H-pyrazol-4-yl)methanone (CID 60959056) is (4-cyclopropylpiperazin-1-yl)-(1H-pyrazol-4-yl)methanone.
What is the SMILES notation for (4-cyclopropylpiperazin-1-yl)-(1H-pyrazol-4-yl)methanone?
The canonical SMILES for (4-cyclopropylpiperazin-1-yl)-(1H-pyrazol-4-yl)methanone is O=C(c1cn[nH]c1)N1CCN(C2CC2)CC1.
What is the InChIKey of (4-cyclopropylpiperazin-1-yl)-(1H-pyrazol-4-yl)methanone?
The InChIKey is PEACURHDZLMBII-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O/c16-11(9-7-12-13-8-9)15-5-3-14(4-6-15)10-1-2-10/h7-8,10H,1-6H2,(H,12,13).
What are the key properties of (4-cyclopropylpiperazin-1-yl)-(1H-pyrazol-4-yl)methanone?
(4-cyclopropylpiperazin-1-yl)-(1H-pyrazol-4-yl)methanone has a molecular weight of 220.28 g/mol, XLogP of 0.33, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-cyclopropylpiperazin-1-yl)-(1H-pyrazol-4-yl)methanone is sourced from PubChem (CID 60959056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).