1-[4-[(1R)-1-(sulfamoylamino)ethyl]phenyl]imidazole

C11H14N4O2S — CID 97088566

IUPAC1-[4-[(1R)-1-(sulfamoylamino)ethyl]phenyl]imidazole
SMILESC[C@@H](NS(N)(=O)=O)c1ccc(-n2ccnc2)cc1
InChIInChI=1S/C11H14N4O2S/c1-9(14-18(12,16)17)10-2-4-11(5-3-10)15-7-6-13-8-15/h2-9,14H,1H3,(H2,12,16,17)/t9-/m1/s1
InChIKeyAOGZJMQWOHLKAY-SECBINFHSA-N
MW266.33 g/mol
LogP0.73
Rot. Bonds4

About 1-[4-[(1R)-1-(sulfamoylamino)ethyl]phenyl]imidazole

1-[4-[(1R)-1-(sulfamoylamino)ethyl]phenyl]imidazole (PubChem CID 97088566) has the molecular formula C11H14N4O2S and a molecular weight of 266.33 g/mol. Its IUPAC name is 1-[4-[(1R)-1-(sulfamoylamino)ethyl]phenyl]imidazole.

Molecular Properties

Compound Name1-[4-[(1R)-1-(sulfamoylamino)ethyl]phenyl]imidazole
PubChem CID97088566
Molecular FormulaC11H14N4O2S
Molecular Weight266.33 g/mol
Exact Mass266.08
IUPAC Name1-[4-[(1R)-1-(sulfamoylamino)ethyl]phenyl]imidazole
SMILESC[C@@H](NS(N)(=O)=O)c1ccc(-n2ccnc2)cc1
InChIInChI=1S/C11H14N4O2S/c1-9(14-18(12,16)17)10-2-4-11(5-3-10)15-7-6-13-8-15/h2-9,14H,1H3,(H2,12,16,17)/t9-/m1/s1
InChIKeyAOGZJMQWOHLKAY-SECBINFHSA-N
XLogP0.73
TPSA90.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.33
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1S)-1-(4-imidazol-1-ylphenyl)ethyl]azetidine-1-sulfonamide
CID 166308955
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CID 51429093
4-bromo-N-[(1R)-1-(4-imidazol-1-ylphenyl)ethyl]benzenesulfonamide
CID 40663815
1,3-bis[1-(4-imidazol-1-ylphenyl)ethyl]urea
CID 174999274
N-[(1R)-1-(4-imidazol-1-ylphenyl)ethyl]-4-(trifluoromethyl)benzenesulfonamide
CID 40663889
N-[(1R)-1-(4-imidazol-1-ylphenyl)ethyl]-4-nitrobenzenesulfonamide
CID 40663817
4-bromo-2-chloro-N-[(1R)-1-(4-imidazol-1-ylphenyl)ethyl]benzenesulfonamide
CID 25352209
3-fluoro-N-[1-(4-imidazol-1-ylphenyl)ethyl]benzenesulfonamide
CID 17441104
3-chloro-4-fluoro-N-[1-(4-imidazol-1-ylphenyl)ethyl]benzenesulfonamide
CID 46799865
1-(4-imidazol-1-ylphenyl)ethanamine;dihydrochloride
CID 91654248
1-[(1R)-1-(4-imidazol-1-ylphenyl)ethyl]-3-[(1R)-1-phenylethyl]urea
CID 36870824
N-[(1R)-1-(4-imidazol-1-ylphenyl)ethyl]-2-methyl-5-nitrobenzenesulfonamide
CID 7306030

Frequently Asked Questions

What is the IUPAC name of 1-[4-[(1R)-1-(sulfamoylamino)ethyl]phenyl]imidazole?
The IUPAC name of 1-[4-[(1R)-1-(sulfamoylamino)ethyl]phenyl]imidazole (CID 97088566) is 1-[4-[(1R)-1-(sulfamoylamino)ethyl]phenyl]imidazole.
What is the SMILES notation for 1-[4-[(1R)-1-(sulfamoylamino)ethyl]phenyl]imidazole?
The canonical SMILES for 1-[4-[(1R)-1-(sulfamoylamino)ethyl]phenyl]imidazole is C[C@@H](NS(N)(=O)=O)c1ccc(-n2ccnc2)cc1.
What is the InChIKey of 1-[4-[(1R)-1-(sulfamoylamino)ethyl]phenyl]imidazole?
The InChIKey is AOGZJMQWOHLKAY-SECBINFHSA-N. The full InChI is InChI=1S/C11H14N4O2S/c1-9(14-18(12,16)17)10-2-4-11(5-3-10)15-7-6-13-8-15/h2-9,14H,1H3,(H2,12,16,17)/t9-/m1/s1.
What are the key properties of 1-[4-[(1R)-1-(sulfamoylamino)ethyl]phenyl]imidazole?
1-[4-[(1R)-1-(sulfamoylamino)ethyl]phenyl]imidazole has a molecular weight of 266.33 g/mol, XLogP of 0.73, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[(1R)-1-(sulfamoylamino)ethyl]phenyl]imidazole is sourced from PubChem (CID 97088566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).