2-amino-N-methyl-N-(2-methylcyclohexyl)pyrimidine-5-sulfonamide

C12H20N4O2S — CID 62159050

IUPAC2-amino-N-methyl-N-(2-methylcyclohexyl)pyrimidine-5-sulfonamide
SMILESCC1CCCCC1N(C)S(=O)(=O)c1cnc(N)nc1
InChIInChI=1S/C12H20N4O2S/c1-9-5-3-4-6-11(9)16(2)19(17,18)10-7-14-12(13)15-8-10/h7-9,11H,3-6H2,1-2H3,(H2,13,14,15)
InChIKeyYJAPRVUZDCPCCW-UHFFFAOYSA-N
MW284.38 g/mol
LogP1.26
Rot. Bonds3

About 2-amino-N-methyl-N-(2-methylcyclohexyl)pyrimidine-5-sulfonamide

2-amino-N-methyl-N-(2-methylcyclohexyl)pyrimidine-5-sulfonamide (PubChem CID 62159050) has the molecular formula C12H20N4O2S and a molecular weight of 284.38 g/mol. Its IUPAC name is 2-amino-N-methyl-N-(2-methylcyclohexyl)pyrimidine-5-sulfonamide.

Molecular Properties

Compound Name2-amino-N-methyl-N-(2-methylcyclohexyl)pyrimidine-5-sulfonamide
PubChem CID62159050
Molecular FormulaC12H20N4O2S
Molecular Weight284.38 g/mol
Exact Mass284.13
IUPAC Name2-amino-N-methyl-N-(2-methylcyclohexyl)pyrimidine-5-sulfonamide
SMILESCC1CCCCC1N(C)S(=O)(=O)c1cnc(N)nc1
InChIInChI=1S/C12H20N4O2S/c1-9-5-3-4-6-11(9)16(2)19(17,18)10-7-14-12(13)15-8-10/h7-9,11H,3-6H2,1-2H3,(H2,13,14,15)
InChIKeyYJAPRVUZDCPCCW-UHFFFAOYSA-N
XLogP1.26
TPSA89.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.38
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-N-cyclopentyl-N-methylpyrimidine-5-sulfonamide
CID 62142744
4-bromo-N-methyl-N-(2-methylcyclohexyl)benzenesulfonamide
CID 47165024
2-amino-N-(4-ethylcyclohexyl)-N-methylpyrimidine-5-sulfonamide
CID 62153482
2-chloro-N-methyl-N-(2-methylcyclohexyl)pyridine-4-sulfonamide
CID 61046115
3-amino-5-fluoro-N,4-dimethyl-N-(2-methylcyclohexyl)benzenesulfonamide
CID 116791589
N,3,4-trimethyl-N-(2-methylcyclohexyl)benzenesulfonamide
CID 47165021
3-hydroxy-N-methyl-N-(2-methylcyclohexyl)benzenesulfonamide
CID 81258647
2-amino-4,6-dichloro-N-methyl-N-(2-methylcyclohexyl)benzenesulfonamide
CID 63402311
2-chloro-N-methyl-N-(2-methylcyclohexyl)pyridine-3-sulfonamide
CID 61046113
N-methyl-N-(2-methylcyclohexyl)-2,3-dihydro-1H-isoindole-5-sulfonamide
CID 107422029
5-bromo-N-methyl-2-(methylamino)-N-(2-methylcyclohexyl)pyridine-3-sulfonamide
CID 62159209
5-amino-2-ethyl-N-methyl-N-(2-methylcyclohexyl)benzenesulfonamide
CID 61113686

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-methyl-N-(2-methylcyclohexyl)pyrimidine-5-sulfonamide?
The IUPAC name of 2-amino-N-methyl-N-(2-methylcyclohexyl)pyrimidine-5-sulfonamide (CID 62159050) is 2-amino-N-methyl-N-(2-methylcyclohexyl)pyrimidine-5-sulfonamide.
What is the SMILES notation for 2-amino-N-methyl-N-(2-methylcyclohexyl)pyrimidine-5-sulfonamide?
The canonical SMILES for 2-amino-N-methyl-N-(2-methylcyclohexyl)pyrimidine-5-sulfonamide is CC1CCCCC1N(C)S(=O)(=O)c1cnc(N)nc1.
What is the InChIKey of 2-amino-N-methyl-N-(2-methylcyclohexyl)pyrimidine-5-sulfonamide?
The InChIKey is YJAPRVUZDCPCCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O2S/c1-9-5-3-4-6-11(9)16(2)19(17,18)10-7-14-12(13)15-8-10/h7-9,11H,3-6H2,1-2H3,(H2,13,14,15).
What are the key properties of 2-amino-N-methyl-N-(2-methylcyclohexyl)pyrimidine-5-sulfonamide?
2-amino-N-methyl-N-(2-methylcyclohexyl)pyrimidine-5-sulfonamide has a molecular weight of 284.38 g/mol, XLogP of 1.26, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-methyl-N-(2-methylcyclohexyl)pyrimidine-5-sulfonamide is sourced from PubChem (CID 62159050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).