N-[2-[[4-(dimethylamino)-5-methylpyrimidin-2-yl]amino]ethyl]-N-methylmethanesulfonamide

C11H21N5O2S — CID 50949787

IUPACN-[2-[[4-(dimethylamino)-5-methylpyrimidin-2-yl]amino]ethyl]-N-methylmethanesulfonamide
SMILESCc1cnc(NCCN(C)S(C)(=O)=O)nc1N(C)C
InChIInChI=1S/C11H21N5O2S/c1-9-8-13-11(14-10(9)15(2)3)12-6-7-16(4)19(5,17)18/h8H,6-7H2,1-5H3,(H,12,13,14)
InChIKeyWUBRLIDZFMTQKX-UHFFFAOYSA-N
MW287.39 g/mol
LogP0.15
Rot. Bonds6

About N-[2-[[4-(dimethylamino)-5-methylpyrimidin-2-yl]amino]ethyl]-N-methylmethanesulfonamide

N-[2-[[4-(dimethylamino)-5-methylpyrimidin-2-yl]amino]ethyl]-N-methylmethanesulfonamide (PubChem CID 50949787) has the molecular formula C11H21N5O2S and a molecular weight of 287.39 g/mol. Its IUPAC name is N-[2-[[4-(dimethylamino)-5-methylpyrimidin-2-yl]amino]ethyl]-N-methylmethanesulfonamide.

Molecular Properties

Compound NameN-[2-[[4-(dimethylamino)-5-methylpyrimidin-2-yl]amino]ethyl]-N-methylmethanesulfonamide
PubChem CID50949787
Molecular FormulaC11H21N5O2S
Molecular Weight287.39 g/mol
Exact Mass287.14
IUPAC NameN-[2-[[4-(dimethylamino)-5-methylpyrimidin-2-yl]amino]ethyl]-N-methylmethanesulfonamide
SMILESCc1cnc(NCCN(C)S(C)(=O)=O)nc1N(C)C
InChIInChI=1S/C11H21N5O2S/c1-9-8-13-11(14-10(9)15(2)3)12-6-7-16(4)19(5,17)18/h8H,6-7H2,1-5H3,(H,12,13,14)
InChIKeyWUBRLIDZFMTQKX-UHFFFAOYSA-N
XLogP0.15
TPSA78.43 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.39
LogP ≤ 50.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

(E)-3-(5-Methyl-2-pyrimidinyl)-2-butene-2-sulfonamide
CID 122701338
2-[(5-Ethylpyrimidin-2-YL)amino]-N,N-dimethylethanesulfonamide
CID 72927155
N~2~-(1,1-dioxidotetrahydro-2H-thiopyran-4-yl)-N~4~,N~4~,5-trimethylpyrimidine-2,4-diamine
CID 50955867
N-[2-[methyl(pyrimidin-2-yl)amino]ethyl]methanesulfonamide
CID 56789846
5-methyl-N-(3-methylsulfonylpropyl)pyrimidin-2-amine
CID 63208027
N-{[4-(dimethylamino)pyrimidin-2-yl]methyl}methanesulfonamide
CID 73168019
2-N-[(2S)-2-(dimethylamino)pentyl]-4-N,4-N,5-trimethylpyrimidine-2,4-diamine
CID 125523390
N-[3-[[4-(2,2-difluoroethylamino)-5-fluoropyrimidin-2-yl]amino]propyl]ethanesulfonamide
CID 132312827
2-chloro-N-(1-methylsulfonylazetidin-3-yl)-5-(trifluoromethyl)pyrimidin-4-amine
CID 118464616
2-chloro-5-fluoro-N-(1-methylsulfonylazetidin-3-yl)pyrimidin-4-amine
CID 126629685
4-N-[(1-methylsulfonylpiperidin-2-yl)methyl]-5-(trifluoromethyl)pyrimidine-2,4-diamine
CID 141126352
4-N-[(3R)-1-methylsulfonylpiperidin-3-yl]-5-(trifluoromethyl)pyrimidine-2,4-diamine
CID 141126356

Frequently Asked Questions

What is the IUPAC name of N-[2-[[4-(dimethylamino)-5-methylpyrimidin-2-yl]amino]ethyl]-N-methylmethanesulfonamide?
The IUPAC name of N-[2-[[4-(dimethylamino)-5-methylpyrimidin-2-yl]amino]ethyl]-N-methylmethanesulfonamide (CID 50949787) is N-[2-[[4-(dimethylamino)-5-methylpyrimidin-2-yl]amino]ethyl]-N-methylmethanesulfonamide.
What is the SMILES notation for N-[2-[[4-(dimethylamino)-5-methylpyrimidin-2-yl]amino]ethyl]-N-methylmethanesulfonamide?
The canonical SMILES for N-[2-[[4-(dimethylamino)-5-methylpyrimidin-2-yl]amino]ethyl]-N-methylmethanesulfonamide is Cc1cnc(NCCN(C)S(C)(=O)=O)nc1N(C)C.
What is the InChIKey of N-[2-[[4-(dimethylamino)-5-methylpyrimidin-2-yl]amino]ethyl]-N-methylmethanesulfonamide?
The InChIKey is WUBRLIDZFMTQKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N5O2S/c1-9-8-13-11(14-10(9)15(2)3)12-6-7-16(4)19(5,17)18/h8H,6-7H2,1-5H3,(H,12,13,14).
What are the key properties of N-[2-[[4-(dimethylamino)-5-methylpyrimidin-2-yl]amino]ethyl]-N-methylmethanesulfonamide?
N-[2-[[4-(dimethylamino)-5-methylpyrimidin-2-yl]amino]ethyl]-N-methylmethanesulfonamide has a molecular weight of 287.39 g/mol, XLogP of 0.15, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[[4-(dimethylamino)-5-methylpyrimidin-2-yl]amino]ethyl]-N-methylmethanesulfonamide is sourced from PubChem (CID 50949787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).