N-methyl-2-(methylamino)-N-phenylpyrimidine-5-sulfonamide

C12H14N4O2S — CID 62148831

IUPACN-methyl-2-(methylamino)-N-phenylpyrimidine-5-sulfonamide
SMILESCNc1ncc(S(=O)(=O)N(C)c2ccccc2)cn1
InChIInChI=1S/C12H14N4O2S/c1-13-12-14-8-11(9-15-12)19(17,18)16(2)10-6-4-3-5-7-10/h3-9H,1-2H3,(H,13,14,15)
InChIKeyWVLCTUABVOWQDP-UHFFFAOYSA-N
MW278.34 g/mol
LogP1.34
Rot. Bonds4

About N-methyl-2-(methylamino)-N-phenylpyrimidine-5-sulfonamide

N-methyl-2-(methylamino)-N-phenylpyrimidine-5-sulfonamide (PubChem CID 62148831) has the molecular formula C12H14N4O2S and a molecular weight of 278.34 g/mol. Its IUPAC name is N-methyl-2-(methylamino)-N-phenylpyrimidine-5-sulfonamide.

Molecular Properties

Compound NameN-methyl-2-(methylamino)-N-phenylpyrimidine-5-sulfonamide
PubChem CID62148831
Molecular FormulaC12H14N4O2S
Molecular Weight278.34 g/mol
Exact Mass278.08
IUPAC NameN-methyl-2-(methylamino)-N-phenylpyrimidine-5-sulfonamide
SMILESCNc1ncc(S(=O)(=O)N(C)c2ccccc2)cn1
InChIInChI=1S/C12H14N4O2S/c1-13-12-14-8-11(9-15-12)19(17,18)16(2)10-6-4-3-5-7-10/h3-9H,1-2H3,(H,13,14,15)
InChIKeyWVLCTUABVOWQDP-UHFFFAOYSA-N
XLogP1.34
TPSA75.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.34
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-benzyl-N-methyl-2-(methylamino)pyrimidine-5-sulfonamide
CID 62150452
6-chloro-N-methyl-N-phenylpyridine-3-sulfonamide
CID 2529980
N-(2,4-dimethylphenyl)-N-methyl-2-(methylamino)pyrimidine-5-sulfonamide
CID 62158827
6-chloro-N,5-dimethyl-N-phenylpyridine-3-sulfonamide
CID 56805912
N-[(2-chlorophenyl)methyl]-N-methyl-2-(methylamino)pyrimidine-5-sulfonamide
CID 62152999
2-(ethylamino)-N-methyl-N-pyridin-4-ylpyrimidine-5-sulfonamide
CID 106936969
N-methyl-2-(methylamino)-N-(2,2,2-trifluoroethyl)pyrimidine-5-sulfonamide
CID 62145454
2-(ethylamino)-N-(4-fluorophenyl)-N-methylpyrimidine-5-sulfonamide
CID 62157505
N,N-diphenylbenzenesulfonamide;N-methyl-N-phenylbenzenesulfonamide
CID 158565705
5-chloro-6-(ethylamino)-N-methyl-N-phenylpyridine-3-sulfonamide
CID 64606805
N-methyl-2-(propylamino)-N-pyridin-4-ylpyrimidine-5-sulfonamide
CID 106937024
5-amino-N-methyl-N-phenylpyridine-3-sulfonamide
CID 82222998

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(methylamino)-N-phenylpyrimidine-5-sulfonamide?
The IUPAC name of N-methyl-2-(methylamino)-N-phenylpyrimidine-5-sulfonamide (CID 62148831) is N-methyl-2-(methylamino)-N-phenylpyrimidine-5-sulfonamide.
What is the SMILES notation for N-methyl-2-(methylamino)-N-phenylpyrimidine-5-sulfonamide?
The canonical SMILES for N-methyl-2-(methylamino)-N-phenylpyrimidine-5-sulfonamide is CNc1ncc(S(=O)(=O)N(C)c2ccccc2)cn1.
What is the InChIKey of N-methyl-2-(methylamino)-N-phenylpyrimidine-5-sulfonamide?
The InChIKey is WVLCTUABVOWQDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O2S/c1-13-12-14-8-11(9-15-12)19(17,18)16(2)10-6-4-3-5-7-10/h3-9H,1-2H3,(H,13,14,15).
What are the key properties of N-methyl-2-(methylamino)-N-phenylpyrimidine-5-sulfonamide?
N-methyl-2-(methylamino)-N-phenylpyrimidine-5-sulfonamide has a molecular weight of 278.34 g/mol, XLogP of 1.34, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(methylamino)-N-phenylpyrimidine-5-sulfonamide is sourced from PubChem (CID 62148831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).