N-[1-[(4-amino-1,3-dimethylpyrazol-5-yl)amino]-2-methylpropan-2-yl]methanesulfonamide

C10H21N5O2S — CID 63863549

IUPACN-[1-[(4-amino-1,3-dimethylpyrazol-5-yl)amino]-2-methylpropan-2-yl]methanesulfonamide
SMILESCc1nn(C)c(NCC(C)(C)NS(C)(=O)=O)c1N
InChIInChI=1S/C10H21N5O2S/c1-7-8(11)9(15(4)13-7)12-6-10(2,3)14-18(5,16)17/h12,14H,6,11H2,1-5H3
InChIKeyRFEGTUTVXXXMJS-UHFFFAOYSA-N
MW275.38 g/mol
LogP0.05
Rot. Bonds5

About N-[1-[(4-amino-1,3-dimethylpyrazol-5-yl)amino]-2-methylpropan-2-yl]methanesulfonamide

N-[1-[(4-amino-1,3-dimethylpyrazol-5-yl)amino]-2-methylpropan-2-yl]methanesulfonamide (PubChem CID 63863549) has the molecular formula C10H21N5O2S and a molecular weight of 275.38 g/mol. Its IUPAC name is N-[1-[(4-amino-1,3-dimethylpyrazol-5-yl)amino]-2-methylpropan-2-yl]methanesulfonamide.

Molecular Properties

Compound NameN-[1-[(4-amino-1,3-dimethylpyrazol-5-yl)amino]-2-methylpropan-2-yl]methanesulfonamide
PubChem CID63863549
Molecular FormulaC10H21N5O2S
Molecular Weight275.38 g/mol
Exact Mass275.14
IUPAC NameN-[1-[(4-amino-1,3-dimethylpyrazol-5-yl)amino]-2-methylpropan-2-yl]methanesulfonamide
SMILESCc1nn(C)c(NCC(C)(C)NS(C)(=O)=O)c1N
InChIInChI=1S/C10H21N5O2S/c1-7-8(11)9(15(4)13-7)12-6-10(2,3)14-18(5,16)17/h12,14H,6,11H2,1-5H3
InChIKeyRFEGTUTVXXXMJS-UHFFFAOYSA-N
XLogP0.05
TPSA102.04 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.38
LogP ≤ 50.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[1-[(4-amino-1,3-dimethylpyrazol-5-yl)amino]-2-methylpropan-2-yl]methanesulfonamide?
The IUPAC name of N-[1-[(4-amino-1,3-dimethylpyrazol-5-yl)amino]-2-methylpropan-2-yl]methanesulfonamide (CID 63863549) is N-[1-[(4-amino-1,3-dimethylpyrazol-5-yl)amino]-2-methylpropan-2-yl]methanesulfonamide.
What is the SMILES notation for N-[1-[(4-amino-1,3-dimethylpyrazol-5-yl)amino]-2-methylpropan-2-yl]methanesulfonamide?
The canonical SMILES for N-[1-[(4-amino-1,3-dimethylpyrazol-5-yl)amino]-2-methylpropan-2-yl]methanesulfonamide is Cc1nn(C)c(NCC(C)(C)NS(C)(=O)=O)c1N.
What is the InChIKey of N-[1-[(4-amino-1,3-dimethylpyrazol-5-yl)amino]-2-methylpropan-2-yl]methanesulfonamide?
The InChIKey is RFEGTUTVXXXMJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N5O2S/c1-7-8(11)9(15(4)13-7)12-6-10(2,3)14-18(5,16)17/h12,14H,6,11H2,1-5H3.
What are the key properties of N-[1-[(4-amino-1,3-dimethylpyrazol-5-yl)amino]-2-methylpropan-2-yl]methanesulfonamide?
N-[1-[(4-amino-1,3-dimethylpyrazol-5-yl)amino]-2-methylpropan-2-yl]methanesulfonamide has a molecular weight of 275.38 g/mol, XLogP of 0.05, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(4-amino-1,3-dimethylpyrazol-5-yl)amino]-2-methylpropan-2-yl]methanesulfonamide is sourced from PubChem (CID 63863549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).