3-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)-1H-pyrazole-5-carboxamide

C14H16N4O3S — CID 167774919

IUPAC3-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)-1H-pyrazole-5-carboxamide
SMILESNC(=O)c1cc(NS(=O)(=O)c2ccc3c(c2)CCCC3)n[nH]1
InChIInChI=1S/C14H16N4O3S/c15-14(19)12-8-13(17-16-12)18-22(20,21)11-6-5-9-3-1-2-4-10(9)7-11/h5-8H,1-4H2,(H2,15,19)(H2,16,17,18)
InChIKeyLFDZAUOGOMUDTG-UHFFFAOYSA-N
MW320.37 g/mol
LogP1.19
Rot. Bonds4

About 3-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)-1H-pyrazole-5-carboxamide

3-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)-1H-pyrazole-5-carboxamide (PubChem CID 167774919) has the molecular formula C14H16N4O3S and a molecular weight of 320.37 g/mol. Its IUPAC name is 3-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound Name3-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)-1H-pyrazole-5-carboxamide
PubChem CID167774919
Molecular FormulaC14H16N4O3S
Molecular Weight320.37 g/mol
Exact Mass320.09
IUPAC Name3-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)-1H-pyrazole-5-carboxamide
SMILESNC(=O)c1cc(NS(=O)(=O)c2ccc3c(c2)CCCC3)n[nH]1
InChIInChI=1S/C14H16N4O3S/c15-14(19)12-8-13(17-16-12)18-22(20,21)11-6-5-9-3-1-2-4-10(9)7-11/h5-8H,1-4H2,(H2,15,19)(H2,16,17,18)
InChIKeyLFDZAUOGOMUDTG-UHFFFAOYSA-N
XLogP1.19
TPSA117.94 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.37
LogP ≤ 51.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-pyridin-4-yl-1H-pyrazol-3-yl)-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
CID 110281086
N-(5-pyridin-4-yl-1H-pyrazol-3-yl)-2,3-dihydro-1H-indene-5-sulfonamide
CID 110281087
N-[5-(3,5-dimethylphenyl)-1H-pyrazol-3-yl]-2,3-dihydro-1H-indene-5-sulfonamide
CID 166374396
N-(4,5-dimethyl-1H-pyrazol-3-yl)-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
CID 115750894
3-[(2,6-dimethoxyphenyl)sulfonylamino]-1H-pyrazole-5-carboxamide
CID 167818865
[4-(2,3-dihydro-1H-inden-5-ylsulfonylamino)phenyl]urea
CID 33488490
N-(2-chloropyrimidin-4-yl)-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
CID 116798867
3-[(2-propylphenyl)sulfonylamino]-1H-pyrazole-5-carboxamide
CID 167944646
N-(1H-1,2,4-triazol-5-yl)-2,3-dihydro-1H-indene-5-sulfonamide
CID 39854348
5-(2,3-dihydro-1H-inden-5-ylsulfonylamino)-1H-pyrazole-4-carbothioamide
CID 79497738
N-[5-(cyclopentylamino)-2-pyridinyl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
CID 113024520
2-pyrrolidin-1-yl-5-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)pyridine-3-carboxylic acid
CID 53004776

Frequently Asked Questions

What is the IUPAC name of 3-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)-1H-pyrazole-5-carboxamide?
The IUPAC name of 3-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)-1H-pyrazole-5-carboxamide (CID 167774919) is 3-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)-1H-pyrazole-5-carboxamide.
What is the SMILES notation for 3-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)-1H-pyrazole-5-carboxamide?
The canonical SMILES for 3-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)-1H-pyrazole-5-carboxamide is NC(=O)c1cc(NS(=O)(=O)c2ccc3c(c2)CCCC3)n[nH]1.
What is the InChIKey of 3-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)-1H-pyrazole-5-carboxamide?
The InChIKey is LFDZAUOGOMUDTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O3S/c15-14(19)12-8-13(17-16-12)18-22(20,21)11-6-5-9-3-1-2-4-10(9)7-11/h5-8H,1-4H2,(H2,15,19)(H2,16,17,18).
What are the key properties of 3-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)-1H-pyrazole-5-carboxamide?
3-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)-1H-pyrazole-5-carboxamide has a molecular weight of 320.37 g/mol, XLogP of 1.19, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 167774919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).