5-bromo-N-methyl-N-piperidin-3-ylpyrimidin-4-amine

C10H15BrN4 — CID 66320623

IUPAC5-bromo-N-methyl-N-piperidin-3-ylpyrimidin-4-amine
SMILESCN(c1ncncc1Br)C1CCCNC1
InChIInChI=1S/C10H15BrN4/c1-15(8-3-2-4-12-5-8)10-9(11)6-13-7-14-10/h6-8,12H,2-5H2,1H3
InChIKeyMGWXSDJFWLVHGL-UHFFFAOYSA-N
MW271.16 g/mol
LogP1.43
Rot. Bonds2

About 5-bromo-N-methyl-N-piperidin-3-ylpyrimidin-4-amine

5-bromo-N-methyl-N-piperidin-3-ylpyrimidin-4-amine (PubChem CID 66320623) has the molecular formula C10H15BrN4 and a molecular weight of 271.16 g/mol. Its IUPAC name is 5-bromo-N-methyl-N-piperidin-3-ylpyrimidin-4-amine.

Molecular Properties

Compound Name5-bromo-N-methyl-N-piperidin-3-ylpyrimidin-4-amine
PubChem CID66320623
Molecular FormulaC10H15BrN4
Molecular Weight271.16 g/mol
Exact Mass270.05
IUPAC Name5-bromo-N-methyl-N-piperidin-3-ylpyrimidin-4-amine
SMILESCN(c1ncncc1Br)C1CCCNC1
InChIInChI=1S/C10H15BrN4/c1-15(8-3-2-4-12-5-8)10-9(11)6-13-7-14-10/h6-8,12H,2-5H2,1H3
InChIKeyMGWXSDJFWLVHGL-UHFFFAOYSA-N
XLogP1.43
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.16
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-N-piperidin-3-ylquinazolin-4-amine
CID 55249323
N-methyl-N-piperidin-3-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 63643061
5-bromo-N,2-dimethyl-N-pyrrolidin-3-ylpyrimidin-4-amine
CID 83844947
N-methyl-N-piperidin-3-ylpyridin-3-amine
CID 83698004
3-chloro-N-methyl-N-[(3R)-piperidin-3-yl]-5-(trifluoromethyl)pyridin-2-amine
CID 71640871
5-ethyl-N-methyl-N-piperidin-3-ylpyrimidin-2-amine
CID 116977534
3-chloro-N-methyl-N-[(3S)-piperidin-3-yl]-5-(trifluoromethyl)pyridin-2-amine;hydrochloride
CID 71641080
N,5,6-trimethyl-N-pyrrolidin-3-ylpyrimidin-4-amine
CID 83833515
N-methyl-N-piperidin-3-yl-3-(trifluoromethyl)pyridin-2-amine;dihydrochloride
CID 146077841
5-chloro-N-methyl-N-(piperidin-3-ylmethyl)pyrimidin-4-amine
CID 106642815
5-iodo-N-methyl-N-(piperidin-3-ylmethyl)pyrimidin-4-amine
CID 106642624
3-chloro-N-methyl-N-piperidin-3-ylpyridin-4-amine
CID 79841702

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-methyl-N-piperidin-3-ylpyrimidin-4-amine?
The IUPAC name of 5-bromo-N-methyl-N-piperidin-3-ylpyrimidin-4-amine (CID 66320623) is 5-bromo-N-methyl-N-piperidin-3-ylpyrimidin-4-amine.
What is the SMILES notation for 5-bromo-N-methyl-N-piperidin-3-ylpyrimidin-4-amine?
The canonical SMILES for 5-bromo-N-methyl-N-piperidin-3-ylpyrimidin-4-amine is CN(c1ncncc1Br)C1CCCNC1.
What is the InChIKey of 5-bromo-N-methyl-N-piperidin-3-ylpyrimidin-4-amine?
The InChIKey is MGWXSDJFWLVHGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15BrN4/c1-15(8-3-2-4-12-5-8)10-9(11)6-13-7-14-10/h6-8,12H,2-5H2,1H3.
What are the key properties of 5-bromo-N-methyl-N-piperidin-3-ylpyrimidin-4-amine?
5-bromo-N-methyl-N-piperidin-3-ylpyrimidin-4-amine has a molecular weight of 271.16 g/mol, XLogP of 1.43, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-methyl-N-piperidin-3-ylpyrimidin-4-amine is sourced from PubChem (CID 66320623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).