N-[[2-(1,4-dimethylpiperazin-2-yl)-6-methylpyrimidin-4-yl]methyl]cyclopropanamine

C15H25N5 — CID 79667225

IUPACN-[[2-(1,4-dimethylpiperazin-2-yl)-6-methylpyrimidin-4-yl]methyl]cyclopropanamine
SMILESCc1cc(CNC2CC2)nc(C2CN(C)CCN2C)n1
InChIInChI=1S/C15H25N5/c1-11-8-13(9-16-12-4-5-12)18-15(17-11)14-10-19(2)6-7-20(14)3/h8,12,14,16H,4-7,9-10H2,1-3H3
InChIKeyNFQGGWUGOOSFCY-UHFFFAOYSA-N
MW275.40 g/mol
LogP0.96
Rot. Bonds4

About N-[[2-(1,4-dimethylpiperazin-2-yl)-6-methylpyrimidin-4-yl]methyl]cyclopropanamine

N-[[2-(1,4-dimethylpiperazin-2-yl)-6-methylpyrimidin-4-yl]methyl]cyclopropanamine (PubChem CID 79667225) has the molecular formula C15H25N5 and a molecular weight of 275.40 g/mol. Its IUPAC name is N-[[2-(1,4-dimethylpiperazin-2-yl)-6-methylpyrimidin-4-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[2-(1,4-dimethylpiperazin-2-yl)-6-methylpyrimidin-4-yl]methyl]cyclopropanamine
PubChem CID79667225
Molecular FormulaC15H25N5
Molecular Weight275.40 g/mol
Exact Mass275.21
IUPAC NameN-[[2-(1,4-dimethylpiperazin-2-yl)-6-methylpyrimidin-4-yl]methyl]cyclopropanamine
SMILESCc1cc(CNC2CC2)nc(C2CN(C)CCN2C)n1
InChIInChI=1S/C15H25N5/c1-11-8-13(9-16-12-4-5-12)18-15(17-11)14-10-19(2)6-7-20(14)3/h8,12,14,16H,4-7,9-10H2,1-3H3
InChIKeyNFQGGWUGOOSFCY-UHFFFAOYSA-N
XLogP0.96
TPSA44.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[2-(1,4-dimethylpiperazin-2-yl)-6-methylpyrimidin-4-yl]butan-2-amine
CID 79666386
N-[(2-cycloheptyl-6-methylpyrimidin-4-yl)methyl]cyclopropanamine
CID 65399678
N-[[2-(azepan-1-yl)-6-methylpyrimidin-4-yl]methyl]cyclopropanamine
CID 55114380
N-[[2-(1,4-dimethylpiperazin-2-yl)-4-propyl-1,3-thiazol-5-yl]methyl]cyclopropanamine
CID 114364492
N-[(6-methyl-2-pyrimidin-2-ylpyrimidin-4-yl)methyl]cyclopropanamine
CID 62746577
N-methyl-1-[6-methyl-2-(4-methylmorpholin-2-yl)pyrimidin-4-yl]methanamine
CID 79089279
[2-(1,4-dimethylpiperazin-2-yl)pyrimidin-4-yl]methanamine
CID 79666220
4,6-dimethyl-2-[(2S)-1-methylpiperidin-2-yl]pyrimidine
CID 95817120
N-[[6-methyl-2-(2-methylbutan-2-yloxy)pyrimidin-4-yl]methyl]cyclopropanamine
CID 114221207
N-[[6-methyl-2-(oxolan-3-ylmethyl)pyrimidin-4-yl]methyl]cyclopropanamine
CID 103987970
N-[[5-[(4-methylpiperazin-1-yl)methyl]-1,2-oxazol-3-yl]methyl]cyclopropanamine
CID 55070405
N-[[6-methyl-2-(3-methylbutan-2-yloxy)pyrimidin-4-yl]methyl]cyclopropanamine
CID 114221355

Frequently Asked Questions

What is the IUPAC name of N-[[2-(1,4-dimethylpiperazin-2-yl)-6-methylpyrimidin-4-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[2-(1,4-dimethylpiperazin-2-yl)-6-methylpyrimidin-4-yl]methyl]cyclopropanamine (CID 79667225) is N-[[2-(1,4-dimethylpiperazin-2-yl)-6-methylpyrimidin-4-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[2-(1,4-dimethylpiperazin-2-yl)-6-methylpyrimidin-4-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[2-(1,4-dimethylpiperazin-2-yl)-6-methylpyrimidin-4-yl]methyl]cyclopropanamine is Cc1cc(CNC2CC2)nc(C2CN(C)CCN2C)n1.
What is the InChIKey of N-[[2-(1,4-dimethylpiperazin-2-yl)-6-methylpyrimidin-4-yl]methyl]cyclopropanamine?
The InChIKey is NFQGGWUGOOSFCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5/c1-11-8-13(9-16-12-4-5-12)18-15(17-11)14-10-19(2)6-7-20(14)3/h8,12,14,16H,4-7,9-10H2,1-3H3.
What are the key properties of N-[[2-(1,4-dimethylpiperazin-2-yl)-6-methylpyrimidin-4-yl]methyl]cyclopropanamine?
N-[[2-(1,4-dimethylpiperazin-2-yl)-6-methylpyrimidin-4-yl]methyl]cyclopropanamine has a molecular weight of 275.40 g/mol, XLogP of 0.96, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(1,4-dimethylpiperazin-2-yl)-6-methylpyrimidin-4-yl]methyl]cyclopropanamine is sourced from PubChem (CID 79667225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).