N,N,4-trimethyl-6-piperazin-1-ylpyrimidin-2-amine

C11H19N5 — CID 83707760

IUPACN,N,4-trimethyl-6-piperazin-1-ylpyrimidin-2-amine
SMILESCc1cc(N2CCNCC2)nc(N(C)C)n1
InChIInChI=1S/C11H19N5/c1-9-8-10(14-11(13-9)15(2)3)16-6-4-12-5-7-16/h8,12H,4-7H2,1-3H3
InChIKeyYDMGAIBUWWPBSS-UHFFFAOYSA-N
MW221.31 g/mol
LogP0.26
Rot. Bonds2

About N,N,4-trimethyl-6-piperazin-1-ylpyrimidin-2-amine

N,N,4-trimethyl-6-piperazin-1-ylpyrimidin-2-amine (PubChem CID 83707760) has the molecular formula C11H19N5 and a molecular weight of 221.31 g/mol. Its IUPAC name is N,N,4-trimethyl-6-piperazin-1-ylpyrimidin-2-amine.

Molecular Properties

Compound NameN,N,4-trimethyl-6-piperazin-1-ylpyrimidin-2-amine
PubChem CID83707760
Molecular FormulaC11H19N5
Molecular Weight221.31 g/mol
Exact Mass221.16
IUPAC NameN,N,4-trimethyl-6-piperazin-1-ylpyrimidin-2-amine
SMILESCc1cc(N2CCNCC2)nc(N(C)C)n1
InChIInChI=1S/C11H19N5/c1-9-8-10(14-11(13-9)15(2)3)16-6-4-12-5-7-16/h8,12H,4-7H2,1-3H3
InChIKeyYDMGAIBUWWPBSS-UHFFFAOYSA-N
XLogP0.26
TPSA44.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.31
LogP ≤ 50.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2,6-Dimethyl-4-aminopyrimidine
CID 68039
6-(4-Methylpiperazin-1-yl)pyrimidine-2,4-diamine
CID 753256
N4-Methyl-6-(4-methylpiperazin-1-yl)pyrimidine-2,4-diamine
CID 25129179
n4-Cyclopentyl-6-(4-methylpiperazin-1-yl)pyrimidine-2,4-diamine
CID 24797598
2,4-Dimethyl-6-(piperazin-1-yl)pyrimidine
CID 4778269
3-(4-(4-(2-Tert-butyl-6-(trifluoromethyl)pyrimidin-4-yl)piperazin-1-yl)butyl)-1,1-diethylurea
CID 44409731
4-Methyl-2,6-di(piperidin-1-yl)pyrimidine
CID 893737
4-Methyl-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine
CID 3228743
4-methyl-6-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidin-2-amine
CID 24994945
4-Ethyl-6-[3-(methylamino)-1-azetidinyl]-2-pyrimidinamine
CID 42623567
4-ethyl-6-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidin-2-amine
CID 42624149
2-N,4-N-dicyclohexyl-6-methylpyrimidine-2,4-diamine
CID 46225979

Frequently Asked Questions

What is the IUPAC name of N,N,4-trimethyl-6-piperazin-1-ylpyrimidin-2-amine?
The IUPAC name of N,N,4-trimethyl-6-piperazin-1-ylpyrimidin-2-amine (CID 83707760) is N,N,4-trimethyl-6-piperazin-1-ylpyrimidin-2-amine.
What is the SMILES notation for N,N,4-trimethyl-6-piperazin-1-ylpyrimidin-2-amine?
The canonical SMILES for N,N,4-trimethyl-6-piperazin-1-ylpyrimidin-2-amine is Cc1cc(N2CCNCC2)nc(N(C)C)n1.
What is the InChIKey of N,N,4-trimethyl-6-piperazin-1-ylpyrimidin-2-amine?
The InChIKey is YDMGAIBUWWPBSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5/c1-9-8-10(14-11(13-9)15(2)3)16-6-4-12-5-7-16/h8,12H,4-7H2,1-3H3.
What are the key properties of N,N,4-trimethyl-6-piperazin-1-ylpyrimidin-2-amine?
N,N,4-trimethyl-6-piperazin-1-ylpyrimidin-2-amine has a molecular weight of 221.31 g/mol, XLogP of 0.26, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,4-trimethyl-6-piperazin-1-ylpyrimidin-2-amine is sourced from PubChem (CID 83707760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).