N,2-dimethyl-6-piperidin-3-ylpyrimidin-4-amine;dihydrochloride

C11H20Cl2N4 — CID 71298952

IUPACN,2-dimethyl-6-piperidin-3-ylpyrimidin-4-amine;dihydrochloride
SMILESCNc1cc(C2CCCNC2)nc(C)n1.Cl.Cl
InChIInChI=1S/C11H18N4.2ClH/c1-8-14-10(6-11(12-2)15-8)9-4-3-5-13-7-9;;/h6,9,13H,3-5,7H2,1-2H3,(H,12,14,15);2*1H
InChIKeySIECJGFQFZEVBV-UHFFFAOYSA-N
MW279.22 g/mol
LogP2.14
Rot. Bonds2

About N,2-dimethyl-6-piperidin-3-ylpyrimidin-4-amine;dihydrochloride

N,2-dimethyl-6-piperidin-3-ylpyrimidin-4-amine;dihydrochloride (PubChem CID 71298952) has the molecular formula C11H20Cl2N4 and a molecular weight of 279.22 g/mol. Its IUPAC name is N,2-dimethyl-6-piperidin-3-ylpyrimidin-4-amine;dihydrochloride.

Molecular Properties

Compound NameN,2-dimethyl-6-piperidin-3-ylpyrimidin-4-amine;dihydrochloride
PubChem CID71298952
Molecular FormulaC11H20Cl2N4
Molecular Weight279.22 g/mol
Exact Mass278.11
IUPAC NameN,2-dimethyl-6-piperidin-3-ylpyrimidin-4-amine;dihydrochloride
SMILESCNc1cc(C2CCCNC2)nc(C)n1.Cl.Cl
InChIInChI=1S/C11H18N4.2ClH/c1-8-14-10(6-11(12-2)15-8)9-4-3-5-13-7-9;;/h6,9,13H,3-5,7H2,1-2H3,(H,12,14,15);2*1H
InChIKeySIECJGFQFZEVBV-UHFFFAOYSA-N
XLogP2.14
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.22
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

Jnj-39758979
CID 24994634
4-Cycloheptyl-6-(3-Piperidin-1-Ylpropyl)pyrimidine-2-Carbonitrile
CID 11669355
4-Cyclopentyl-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine
CID 24797604
4-Cyclopentyl-6-(piperazin-1-yl)-pyrimidin-2-ylamine
CID 24798144
4-[(4aR,7aR)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridin-6-yl]-6-cyclopentylpyrimidin-2-amine
CID 24798232
4-cyclopentyl-6-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidin-2-amine
CID 24994542
4-cyclobutyl-6-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidin-2-amine
CID 53257796
4-[(3R)-3-aminopyrrolidin-1-yl]-6-cyclopentylpyrimidin-2-amine
CID 59777338
4-cyclohexyl-6-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidin-2-amine
CID 59777341
4-t-Butyl-6-(4-methylpiperazin-1-yl)pyrimidin-2-ylamine
CID 24797775
4-(3-Amino-azetidin-1-yl)-6-cyclopentyl-pyrimidin-2-ylamine
CID 24797956
4-butyl-6-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidin-2-amine
CID 24992077

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-6-piperidin-3-ylpyrimidin-4-amine;dihydrochloride?
The IUPAC name of N,2-dimethyl-6-piperidin-3-ylpyrimidin-4-amine;dihydrochloride (CID 71298952) is N,2-dimethyl-6-piperidin-3-ylpyrimidin-4-amine;dihydrochloride.
What is the SMILES notation for N,2-dimethyl-6-piperidin-3-ylpyrimidin-4-amine;dihydrochloride?
The canonical SMILES for N,2-dimethyl-6-piperidin-3-ylpyrimidin-4-amine;dihydrochloride is CNc1cc(C2CCCNC2)nc(C)n1.Cl.Cl.
What is the InChIKey of N,2-dimethyl-6-piperidin-3-ylpyrimidin-4-amine;dihydrochloride?
The InChIKey is SIECJGFQFZEVBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4.2ClH/c1-8-14-10(6-11(12-2)15-8)9-4-3-5-13-7-9;;/h6,9,13H,3-5,7H2,1-2H3,(H,12,14,15);2*1H.
What are the key properties of N,2-dimethyl-6-piperidin-3-ylpyrimidin-4-amine;dihydrochloride?
N,2-dimethyl-6-piperidin-3-ylpyrimidin-4-amine;dihydrochloride has a molecular weight of 279.22 g/mol, XLogP of 2.14, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-6-piperidin-3-ylpyrimidin-4-amine;dihydrochloride is sourced from PubChem (CID 71298952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).