N-(1-pyrazol-1-ylpropan-2-yl)-4-(1,3-thiazol-2-yl)piperazine-1-carboxamide

C14H20N6OS — CID 51084477

IUPACN-(1-pyrazol-1-ylpropan-2-yl)-4-(1,3-thiazol-2-yl)piperazine-1-carboxamide
SMILESCC(Cn1cccn1)NC(=O)N1CCN(c2nccs2)CC1
InChIInChI=1S/C14H20N6OS/c1-12(11-20-5-2-3-16-20)17-13(21)18-6-8-19(9-7-18)14-15-4-10-22-14/h2-5,10,12H,6-9,11H2,1H3,(H,17,21)
InChIKeyXOQIYXBVNVIYHW-UHFFFAOYSA-N
MW320.42 g/mol
LogP1.26
Rot. Bonds4

About N-(1-pyrazol-1-ylpropan-2-yl)-4-(1,3-thiazol-2-yl)piperazine-1-carboxamide

N-(1-pyrazol-1-ylpropan-2-yl)-4-(1,3-thiazol-2-yl)piperazine-1-carboxamide (PubChem CID 51084477) has the molecular formula C14H20N6OS and a molecular weight of 320.42 g/mol. Its IUPAC name is N-(1-pyrazol-1-ylpropan-2-yl)-4-(1,3-thiazol-2-yl)piperazine-1-carboxamide.

Molecular Properties

Compound NameN-(1-pyrazol-1-ylpropan-2-yl)-4-(1,3-thiazol-2-yl)piperazine-1-carboxamide
PubChem CID51084477
Molecular FormulaC14H20N6OS
Molecular Weight320.42 g/mol
Exact Mass320.14
IUPAC NameN-(1-pyrazol-1-ylpropan-2-yl)-4-(1,3-thiazol-2-yl)piperazine-1-carboxamide
SMILESCC(Cn1cccn1)NC(=O)N1CCN(c2nccs2)CC1
InChIInChI=1S/C14H20N6OS/c1-12(11-20-5-2-3-16-20)17-13(21)18-6-8-19(9-7-18)14-15-4-10-22-14/h2-5,10,12H,6-9,11H2,1H3,(H,17,21)
InChIKeyXOQIYXBVNVIYHW-UHFFFAOYSA-N
XLogP1.26
TPSA66.29 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.42
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(2R)-1-pyrazol-1-ylpropan-2-yl]azetidine-1-carboxamide
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4-methylsulfonyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]piperazine-1-carboxamide
CID 94102189
(2S)-2-[[4-(1,3-thiazol-2-yl)piperazine-1-carbonyl]amino]pentanoic acid
CID 107565977
(2S)-3-hydroxy-2-[[4-(1,3-thiazol-2-yl)piperazine-1-carbonyl]amino]propanoic acid
CID 61185673
3-methyl-N-(1-pyrazol-1-ylpropan-2-yl)piperidine-1-carboxamide
CID 115583842
2-(propan-2-ylamino)-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]ethanone
CID 60841085
N-[1-oxo-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]propan-2-yl]acetamide
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ethyl 2-[[4-(1,3-thiazol-2-yl)piperazine-1-carbonyl]amino]acetate
CID 43445563
1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]butan-1-one
CID 158048076
[3-(pyrazol-1-ylmethyl)phenyl]-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone
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N-(2-phenylpropyl)-4-(1,3-thiazol-2-yl)-1,4-diazepane-1-carboxamide
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Frequently Asked Questions

What is the IUPAC name of N-(1-pyrazol-1-ylpropan-2-yl)-4-(1,3-thiazol-2-yl)piperazine-1-carboxamide?
The IUPAC name of N-(1-pyrazol-1-ylpropan-2-yl)-4-(1,3-thiazol-2-yl)piperazine-1-carboxamide (CID 51084477) is N-(1-pyrazol-1-ylpropan-2-yl)-4-(1,3-thiazol-2-yl)piperazine-1-carboxamide.
What is the SMILES notation for N-(1-pyrazol-1-ylpropan-2-yl)-4-(1,3-thiazol-2-yl)piperazine-1-carboxamide?
The canonical SMILES for N-(1-pyrazol-1-ylpropan-2-yl)-4-(1,3-thiazol-2-yl)piperazine-1-carboxamide is CC(Cn1cccn1)NC(=O)N1CCN(c2nccs2)CC1.
What is the InChIKey of N-(1-pyrazol-1-ylpropan-2-yl)-4-(1,3-thiazol-2-yl)piperazine-1-carboxamide?
The InChIKey is XOQIYXBVNVIYHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N6OS/c1-12(11-20-5-2-3-16-20)17-13(21)18-6-8-19(9-7-18)14-15-4-10-22-14/h2-5,10,12H,6-9,11H2,1H3,(H,17,21).
What are the key properties of N-(1-pyrazol-1-ylpropan-2-yl)-4-(1,3-thiazol-2-yl)piperazine-1-carboxamide?
N-(1-pyrazol-1-ylpropan-2-yl)-4-(1,3-thiazol-2-yl)piperazine-1-carboxamide has a molecular weight of 320.42 g/mol, XLogP of 1.26, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-pyrazol-1-ylpropan-2-yl)-4-(1,3-thiazol-2-yl)piperazine-1-carboxamide is sourced from PubChem (CID 51084477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).