5-bromo-N-(6-piperidin-1-yl-3-pyridinyl)pyrimidin-4-amine

C14H16BrN5 — CID 136515524

IUPAC5-bromo-N-(6-piperidin-1-yl-3-pyridinyl)pyrimidin-4-amine
SMILESBrc1cncnc1Nc1ccc(N2CCCCC2)nc1
InChIInChI=1S/C14H16BrN5/c15-12-9-16-10-18-14(12)19-11-4-5-13(17-8-11)20-6-2-1-3-7-20/h4-5,8-10H,1-3,6-7H2,(H,16,18,19)
InChIKeyUXBZVXKULDBDOH-UHFFFAOYSA-N
MW334.22 g/mol
LogP3.37
Rot. Bonds3

About 5-bromo-N-(6-piperidin-1-yl-3-pyridinyl)pyrimidin-4-amine

5-bromo-N-(6-piperidin-1-yl-3-pyridinyl)pyrimidin-4-amine (PubChem CID 136515524) has the molecular formula C14H16BrN5 and a molecular weight of 334.22 g/mol. Its IUPAC name is 5-bromo-N-(6-piperidin-1-yl-3-pyridinyl)pyrimidin-4-amine.

Molecular Properties

Compound Name5-bromo-N-(6-piperidin-1-yl-3-pyridinyl)pyrimidin-4-amine
PubChem CID136515524
Molecular FormulaC14H16BrN5
Molecular Weight334.22 g/mol
Exact Mass333.06
IUPAC Name5-bromo-N-(6-piperidin-1-yl-3-pyridinyl)pyrimidin-4-amine
SMILESBrc1cncnc1Nc1ccc(N2CCCCC2)nc1
InChIInChI=1S/C14H16BrN5/c15-12-9-16-10-18-14(12)19-11-4-5-13(17-8-11)20-6-2-1-3-7-20/h4-5,8-10H,1-3,6-7H2,(H,16,18,19)
InChIKeyUXBZVXKULDBDOH-UHFFFAOYSA-N
XLogP3.37
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.22
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(6-piperidin-1-yl-3-pyridinyl)hydrazine
CID 55281305
1-(5-bromo-2-pyridinyl)azocane
CID 55137358
5-bromo-N-(4-pyrimidin-5-ylphenyl)pyrimidin-4-amine
CID 166223616
N-cyclohexyl-6-piperidin-1-ylpyridin-3-amine
CID 43690330
5-bromo-2-piperidin-1-ylpyridine;hydrochloride
CID 53217409
4-N-(4-pyrrolidin-1-ylphenyl)pyrimidine-4,5-diamine
CID 79917986
N-ethyl-6-pyrrolidin-1-ylpyridin-3-amine
CID 43689606
5-bromo-N-(3-bromo-4-methylphenyl)pyrimidin-4-amine
CID 66318405
N-(cyclopropylmethyl)-6-piperidin-1-ylpyridin-3-amine
CID 43690356
N-(6-piperidin-1-yl-3-pyridinyl)pentanamide
CID 18144003
N-[1-(4-bromophenyl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine
CID 43689538
2-bromo-4-[[(6-pyrrolidin-1-yl-3-pyridinyl)amino]methyl]phenol
CID 63046580

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(6-piperidin-1-yl-3-pyridinyl)pyrimidin-4-amine?
The IUPAC name of 5-bromo-N-(6-piperidin-1-yl-3-pyridinyl)pyrimidin-4-amine (CID 136515524) is 5-bromo-N-(6-piperidin-1-yl-3-pyridinyl)pyrimidin-4-amine.
What is the SMILES notation for 5-bromo-N-(6-piperidin-1-yl-3-pyridinyl)pyrimidin-4-amine?
The canonical SMILES for 5-bromo-N-(6-piperidin-1-yl-3-pyridinyl)pyrimidin-4-amine is Brc1cncnc1Nc1ccc(N2CCCCC2)nc1.
What is the InChIKey of 5-bromo-N-(6-piperidin-1-yl-3-pyridinyl)pyrimidin-4-amine?
The InChIKey is UXBZVXKULDBDOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16BrN5/c15-12-9-16-10-18-14(12)19-11-4-5-13(17-8-11)20-6-2-1-3-7-20/h4-5,8-10H,1-3,6-7H2,(H,16,18,19).
What are the key properties of 5-bromo-N-(6-piperidin-1-yl-3-pyridinyl)pyrimidin-4-amine?
5-bromo-N-(6-piperidin-1-yl-3-pyridinyl)pyrimidin-4-amine has a molecular weight of 334.22 g/mol, XLogP of 3.37, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(6-piperidin-1-yl-3-pyridinyl)pyrimidin-4-amine is sourced from PubChem (CID 136515524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).