5-bromo-6-methyl-N-piperidin-3-ylpyrimidin-4-amine

C10H15BrN4 — CID 83844973

IUPAC5-bromo-6-methyl-N-piperidin-3-ylpyrimidin-4-amine
SMILESCc1ncnc(NC2CCCNC2)c1Br
InChIInChI=1S/C10H15BrN4/c1-7-9(11)10(14-6-13-7)15-8-3-2-4-12-5-8/h6,8,12H,2-5H2,1H3,(H,13,14,15)
InChIKeyOCBCUDOJYYGKPX-UHFFFAOYSA-N
MW271.16 g/mol
LogP1.71
Rot. Bonds2

About 5-bromo-6-methyl-N-piperidin-3-ylpyrimidin-4-amine

5-bromo-6-methyl-N-piperidin-3-ylpyrimidin-4-amine (PubChem CID 83844973) has the molecular formula C10H15BrN4 and a molecular weight of 271.16 g/mol. Its IUPAC name is 5-bromo-6-methyl-N-piperidin-3-ylpyrimidin-4-amine.

Molecular Properties

Compound Name5-bromo-6-methyl-N-piperidin-3-ylpyrimidin-4-amine
PubChem CID83844973
Molecular FormulaC10H15BrN4
Molecular Weight271.16 g/mol
Exact Mass270.05
IUPAC Name5-bromo-6-methyl-N-piperidin-3-ylpyrimidin-4-amine
SMILESCc1ncnc(NC2CCCNC2)c1Br
InChIInChI=1S/C10H15BrN4/c1-7-9(11)10(14-6-13-7)15-8-3-2-4-12-5-8/h6,8,12H,2-5H2,1H3,(H,13,14,15)
InChIKeyOCBCUDOJYYGKPX-UHFFFAOYSA-N
XLogP1.71
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.16
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-methyl-N-piperidin-3-ylpyrazin-2-amine;hydrochloride
CID 71639312
6-methoxy-5-methyl-N-piperidin-3-ylpyrimidin-4-amine
CID 66332962
5-methoxy-6-methyl-N-pyrrolidin-3-ylpyrimidin-4-amine
CID 83834197
3-bromo-4-methyl-N-pyrrolidin-3-ylpyridin-2-amine
CID 106876094
5-bromo-2-methylsulfanyl-N-[(3S)-piperidin-3-yl]pyrimidin-4-amine
CID 58177241
2,3-dimethyl-N-piperidin-3-ylpyridin-4-amine
CID 83833082
N-(3-bromo-5-methyl-2-pyridinyl)azepan-3-amine
CID 105367341
6-methyl-N-[(3S)-piperidin-3-yl]pyrazolo[1,5-a]pyrimidin-5-amine
CID 91221809
N-[(3S)-azepan-3-yl]-7H-purin-6-amine
CID 167844435
5,6-dimethyl-3-(piperidin-3-ylamino)pyridazine-4-carbonitrile
CID 78990540
ethyl 4-[[(3R)-piperidin-3-yl]amino]-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylate
CID 146361976
5-(cyclopropylmethyl)-N-[(3R)-piperidin-3-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine;hydron;chloride
CID 146343759

Frequently Asked Questions

What is the IUPAC name of 5-bromo-6-methyl-N-piperidin-3-ylpyrimidin-4-amine?
The IUPAC name of 5-bromo-6-methyl-N-piperidin-3-ylpyrimidin-4-amine (CID 83844973) is 5-bromo-6-methyl-N-piperidin-3-ylpyrimidin-4-amine.
What is the SMILES notation for 5-bromo-6-methyl-N-piperidin-3-ylpyrimidin-4-amine?
The canonical SMILES for 5-bromo-6-methyl-N-piperidin-3-ylpyrimidin-4-amine is Cc1ncnc(NC2CCCNC2)c1Br.
What is the InChIKey of 5-bromo-6-methyl-N-piperidin-3-ylpyrimidin-4-amine?
The InChIKey is OCBCUDOJYYGKPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15BrN4/c1-7-9(11)10(14-6-13-7)15-8-3-2-4-12-5-8/h6,8,12H,2-5H2,1H3,(H,13,14,15).
What are the key properties of 5-bromo-6-methyl-N-piperidin-3-ylpyrimidin-4-amine?
5-bromo-6-methyl-N-piperidin-3-ylpyrimidin-4-amine has a molecular weight of 271.16 g/mol, XLogP of 1.71, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-6-methyl-N-piperidin-3-ylpyrimidin-4-amine is sourced from PubChem (CID 83844973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).