N-[2-[(2,5-dichloropyrimidin-4-yl)amino]cyclopentyl]methanesulfonamide

C10H14Cl2N4O2S — CID 87330140

IUPACN-[2-[(2,5-dichloropyrimidin-4-yl)amino]cyclopentyl]methanesulfonamide
SMILESCS(=O)(=O)NC1CCCC1Nc1nc(Cl)ncc1Cl
InChIInChI=1S/C10H14Cl2N4O2S/c1-19(17,18)16-8-4-2-3-7(8)14-9-6(11)5-13-10(12)15-9/h5,7-8,16H,2-4H2,1H3,(H,13,14,15)
InChIKeyWOQKRYKXLNRZRW-UHFFFAOYSA-N
MW325.22 g/mol
LogP1.67
Rot. Bonds4

About N-[2-[(2,5-dichloropyrimidin-4-yl)amino]cyclopentyl]methanesulfonamide

N-[2-[(2,5-dichloropyrimidin-4-yl)amino]cyclopentyl]methanesulfonamide (PubChem CID 87330140) has the molecular formula C10H14Cl2N4O2S and a molecular weight of 325.22 g/mol. Its IUPAC name is N-[2-[(2,5-dichloropyrimidin-4-yl)amino]cyclopentyl]methanesulfonamide.

Molecular Properties

Compound NameN-[2-[(2,5-dichloropyrimidin-4-yl)amino]cyclopentyl]methanesulfonamide
PubChem CID87330140
Molecular FormulaC10H14Cl2N4O2S
Molecular Weight325.22 g/mol
Exact Mass324.02
IUPAC NameN-[2-[(2,5-dichloropyrimidin-4-yl)amino]cyclopentyl]methanesulfonamide
SMILESCS(=O)(=O)NC1CCCC1Nc1nc(Cl)ncc1Cl
InChIInChI=1S/C10H14Cl2N4O2S/c1-19(17,18)16-8-4-2-3-7(8)14-9-6(11)5-13-10(12)15-9/h5,7-8,16H,2-4H2,1H3,(H,13,14,15)
InChIKeyWOQKRYKXLNRZRW-UHFFFAOYSA-N
XLogP1.67
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.22
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

cis-(1S,2R)-2-[(2,5-dichloropyrimidin-4-yl)amino]-N-methylcyclopentane-1-carboxamide
CID 87330265
cis-(1S,2R)-2-[(2,5-dichloropyrimidin-4-yl)amino]cyclopentane-1-carboxamide
CID 87330195
2-[(2,5-dichloropyrimidin-4-yl)amino]cyclopentane-1-carbonitrile
CID 174229586
2,5-dichloro-N-cyclopentylpyrimidin-4-amine
CID 79633393
2,5-dichloro-N-[(1R,3S)-3-methylcyclohexyl]pyrimidin-4-amine
CID 122417179
N-(2,5-dichloropyrimidin-4-yl)-2-methylsulfonyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-5-amine
CID 126665269
N-[(1R,2R)-2-[[5-chloro-2-[methyl(2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-8-yl)amino]pyrimidin-4-yl]amino]cyclohexyl]methanesulfonamide
CID 90839037
N-(2,5-dichloropyrimidin-4-yl)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine
CID 79632398
N-[(1R,2R)-2-[[5-chloro-2-[(1-methyl-4-methylsulfonyl-3,5-dihydro-2H-1,4-benzodiazepin-8-yl)amino]pyrimidin-4-yl]amino]cyclohexyl]methanesulfonamide
CID 67263444
2,5-dichloro-N-(2,2,3,3-tetramethylcyclopropyl)pyrimidin-4-amine
CID 79632221
N-[(1R)-2-[[5-chloro-2-[(1-methyl-2,3,4,5-tetrahydro-1,4-benzodiazepin-8-yl)amino]pyrimidin-4-yl]amino]cyclohexyl]methanesulfonamide
CID 67263326
N-[(1R,2R)-2-(methanesulfonamido)cyclohexyl]methanesulfonamide
CID 11043842

Frequently Asked Questions

What is the IUPAC name of N-[2-[(2,5-dichloropyrimidin-4-yl)amino]cyclopentyl]methanesulfonamide?
The IUPAC name of N-[2-[(2,5-dichloropyrimidin-4-yl)amino]cyclopentyl]methanesulfonamide (CID 87330140) is N-[2-[(2,5-dichloropyrimidin-4-yl)amino]cyclopentyl]methanesulfonamide.
What is the SMILES notation for N-[2-[(2,5-dichloropyrimidin-4-yl)amino]cyclopentyl]methanesulfonamide?
The canonical SMILES for N-[2-[(2,5-dichloropyrimidin-4-yl)amino]cyclopentyl]methanesulfonamide is CS(=O)(=O)NC1CCCC1Nc1nc(Cl)ncc1Cl.
What is the InChIKey of N-[2-[(2,5-dichloropyrimidin-4-yl)amino]cyclopentyl]methanesulfonamide?
The InChIKey is WOQKRYKXLNRZRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14Cl2N4O2S/c1-19(17,18)16-8-4-2-3-7(8)14-9-6(11)5-13-10(12)15-9/h5,7-8,16H,2-4H2,1H3,(H,13,14,15).
What are the key properties of N-[2-[(2,5-dichloropyrimidin-4-yl)amino]cyclopentyl]methanesulfonamide?
N-[2-[(2,5-dichloropyrimidin-4-yl)amino]cyclopentyl]methanesulfonamide has a molecular weight of 325.22 g/mol, XLogP of 1.67, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2,5-dichloropyrimidin-4-yl)amino]cyclopentyl]methanesulfonamide is sourced from PubChem (CID 87330140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).