4,5-dimethyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine

C12H20N4 — CID 83838031

IUPAC4,5-dimethyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine
SMILESCc1cnc(NCC2CCCCN2)nc1C
InChIInChI=1S/C12H20N4/c1-9-7-14-12(16-10(9)2)15-8-11-5-3-4-6-13-11/h7,11,13H,3-6,8H2,1-2H3,(H,14,15,16)
InChIKeyDTMPDOPQFLGJJB-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.65
Rot. Bonds3

About 4,5-dimethyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine

4,5-dimethyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine (PubChem CID 83838031) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is 4,5-dimethyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine.

Molecular Properties

Compound Name4,5-dimethyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine
PubChem CID83838031
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC Name4,5-dimethyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine
SMILESCc1cnc(NCC2CCCCN2)nc1C
InChIInChI=1S/C12H20N4/c1-9-7-14-12(16-10(9)2)15-8-11-5-3-4-6-13-11/h7,11,13H,3-6,8H2,1-2H3,(H,14,15,16)
InChIKeyDTMPDOPQFLGJJB-UHFFFAOYSA-N
XLogP1.65
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4,6-dimethyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine;hydrochloride
CID 71638393
5-[2-fluoro-4-(trifluoromethyl)phenyl]-4-methyl-N-[[(2R)-piperidin-2-yl]methyl]pyrimidin-2-amine
CID 170925530
5-tert-butyl-N-(pyrrolidin-2-ylmethyl)pyrimidin-2-amine
CID 116974786
5-cyclohexyl-N-(pyrrolidin-2-ylmethyl)pyrimidin-2-amine
CID 116974804
4-chloro-6-methyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine
CID 71638479
N-(pyrrolidin-2-ylmethyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-2-amine
CID 83841695
5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole
CID 84657560
4-cyclopropyl-N-(pyrrolidin-2-ylmethyl)pyrimidin-2-amine
CID 83836767
N-(piperidin-2-ylmethyl)-1-propan-2-ylimidazol-2-amine
CID 115033626
N-[[(2S)-piperidin-2-yl]methyl]quinoxalin-2-amine
CID 94416055
1,3-dimethyl-N-(piperidin-2-ylmethyl)pyrazolo[5,4-b]pyridin-5-amine
CID 106633425
N-(2-piperidin-2-ylethyl)-5-propan-2-ylpyrimidin-2-amine
CID 116975975

Frequently Asked Questions

What is the IUPAC name of 4,5-dimethyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine?
The IUPAC name of 4,5-dimethyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine (CID 83838031) is 4,5-dimethyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine.
What is the SMILES notation for 4,5-dimethyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine?
The canonical SMILES for 4,5-dimethyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine is Cc1cnc(NCC2CCCCN2)nc1C.
What is the InChIKey of 4,5-dimethyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine?
The InChIKey is DTMPDOPQFLGJJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-9-7-14-12(16-10(9)2)15-8-11-5-3-4-6-13-11/h7,11,13H,3-6,8H2,1-2H3,(H,14,15,16).
What are the key properties of 4,5-dimethyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine?
4,5-dimethyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine has a molecular weight of 220.32 g/mol, XLogP of 1.65, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dimethyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine is sourced from PubChem (CID 83838031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).