N-[1-[6-(dimethylamino)pyrimidin-4-yl]piperidin-3-yl]cyclopropanesulfonamide

C14H23N5O2S — CID 53185789

IUPACN-[1-[6-(dimethylamino)pyrimidin-4-yl]piperidin-3-yl]cyclopropanesulfonamide
SMILESCN(C)c1cc(N2CCCC(NS(=O)(=O)C3CC3)C2)ncn1
InChIInChI=1S/C14H23N5O2S/c1-18(2)13-8-14(16-10-15-13)19-7-3-4-11(9-19)17-22(20,21)12-5-6-12/h8,10-12,17H,3-7,9H2,1-2H3
InChIKeyVDYLANLYIOYTRL-UHFFFAOYSA-N
MW325.44 g/mol
LogP0.59
Rot. Bonds5

About N-[1-[6-(dimethylamino)pyrimidin-4-yl]piperidin-3-yl]cyclopropanesulfonamide

N-[1-[6-(dimethylamino)pyrimidin-4-yl]piperidin-3-yl]cyclopropanesulfonamide (PubChem CID 53185789) has the molecular formula C14H23N5O2S and a molecular weight of 325.44 g/mol. Its IUPAC name is N-[1-[6-(dimethylamino)pyrimidin-4-yl]piperidin-3-yl]cyclopropanesulfonamide.

Molecular Properties

Compound NameN-[1-[6-(dimethylamino)pyrimidin-4-yl]piperidin-3-yl]cyclopropanesulfonamide
PubChem CID53185789
Molecular FormulaC14H23N5O2S
Molecular Weight325.44 g/mol
Exact Mass325.16
IUPAC NameN-[1-[6-(dimethylamino)pyrimidin-4-yl]piperidin-3-yl]cyclopropanesulfonamide
SMILESCN(C)c1cc(N2CCCC(NS(=O)(=O)C3CC3)C2)ncn1
InChIInChI=1S/C14H23N5O2S/c1-18(2)13-8-14(16-10-15-13)19-7-3-4-11(9-19)17-22(20,21)12-5-6-12/h8,10-12,17H,3-7,9H2,1-2H3
InChIKeyVDYLANLYIOYTRL-UHFFFAOYSA-N
XLogP0.59
TPSA78.43 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.44
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-N-ethyl-2-N-(1-methylsulfonylpiperidin-4-yl)pyrimidine-2,4-diamine
CID 50960313
4-(4-(Propylsulfonyl)piperazin-1-yl)-2-(pyrrolidin-1-yl)pyrimidine
CID 70703312
2-(Piperidin-1-yl)-4-(4-(propylsulfonyl)piperazin-1-yl)pyrimidine
CID 70703711
N-[[1-(2-tert-butylpyrimidin-4-yl)piperidin-2-yl]methyl]methanesulfonamide
CID 71978146
N-[2-[1-(2-tert-butylpyrimidin-4-yl)piperidin-2-yl]ethyl]methanesulfonamide
CID 75379307
N-{1-[6-(1-pyrrolidinyl)-4-pyrimidinyl]-3-piperidyl}methanesulfonamide
CID 53185808
N-(2-((6-(ethylamino)-2-methylpyrimidin-4-yl)amino)ethyl)butane-1-sulfonamide
CID 45502760
N-{1-[6-(dimethylamino)-4-pyrimidinyl]-3-piperidyl}methanesulfonamide
CID 53185788
N-[1-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperidin-3-yl]ethanesulfonamide
CID 53185809
N-[6-(3-aminopiperidino)-4-pyrimidinyl]-N,N-dimethylamine
CID 53185813
2-methyl-4-[N,N-dimethylsulfamoyl-piperazino]-pyrimidine
CID 19883994
N-[(3S)-1-methylsulfonylpiperidin-3-yl]pyrimidin-2-amine
CID 94210816

Frequently Asked Questions

What is the IUPAC name of N-[1-[6-(dimethylamino)pyrimidin-4-yl]piperidin-3-yl]cyclopropanesulfonamide?
The IUPAC name of N-[1-[6-(dimethylamino)pyrimidin-4-yl]piperidin-3-yl]cyclopropanesulfonamide (CID 53185789) is N-[1-[6-(dimethylamino)pyrimidin-4-yl]piperidin-3-yl]cyclopropanesulfonamide.
What is the SMILES notation for N-[1-[6-(dimethylamino)pyrimidin-4-yl]piperidin-3-yl]cyclopropanesulfonamide?
The canonical SMILES for N-[1-[6-(dimethylamino)pyrimidin-4-yl]piperidin-3-yl]cyclopropanesulfonamide is CN(C)c1cc(N2CCCC(NS(=O)(=O)C3CC3)C2)ncn1.
What is the InChIKey of N-[1-[6-(dimethylamino)pyrimidin-4-yl]piperidin-3-yl]cyclopropanesulfonamide?
The InChIKey is VDYLANLYIOYTRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O2S/c1-18(2)13-8-14(16-10-15-13)19-7-3-4-11(9-19)17-22(20,21)12-5-6-12/h8,10-12,17H,3-7,9H2,1-2H3.
What are the key properties of N-[1-[6-(dimethylamino)pyrimidin-4-yl]piperidin-3-yl]cyclopropanesulfonamide?
N-[1-[6-(dimethylamino)pyrimidin-4-yl]piperidin-3-yl]cyclopropanesulfonamide has a molecular weight of 325.44 g/mol, XLogP of 0.59, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[6-(dimethylamino)pyrimidin-4-yl]piperidin-3-yl]cyclopropanesulfonamide is sourced from PubChem (CID 53185789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).