5-bromo-6-cyclopropyl-N-propyl-2-pyridin-3-ylpyrimidin-4-amine

C15H17BrN4 — CID 66303575

IUPAC5-bromo-6-cyclopropyl-N-propyl-2-pyridin-3-ylpyrimidin-4-amine
SMILESCCCNc1nc(-c2cccnc2)nc(C2CC2)c1Br
InChIInChI=1S/C15H17BrN4/c1-2-7-18-15-12(16)13(10-5-6-10)19-14(20-15)11-4-3-8-17-9-11/h3-4,8-10H,2,5-7H2,1H3,(H,18,19,20)
InChIKeyPVWRAUPRORPHMZ-UHFFFAOYSA-N
MW333.23 g/mol
LogP4.00
Rot. Bonds5

About 5-bromo-6-cyclopropyl-N-propyl-2-pyridin-3-ylpyrimidin-4-amine

5-bromo-6-cyclopropyl-N-propyl-2-pyridin-3-ylpyrimidin-4-amine (PubChem CID 66303575) has the molecular formula C15H17BrN4 and a molecular weight of 333.23 g/mol. Its IUPAC name is 5-bromo-6-cyclopropyl-N-propyl-2-pyridin-3-ylpyrimidin-4-amine.

Molecular Properties

Compound Name5-bromo-6-cyclopropyl-N-propyl-2-pyridin-3-ylpyrimidin-4-amine
PubChem CID66303575
Molecular FormulaC15H17BrN4
Molecular Weight333.23 g/mol
Exact Mass332.06
IUPAC Name5-bromo-6-cyclopropyl-N-propyl-2-pyridin-3-ylpyrimidin-4-amine
SMILESCCCNc1nc(-c2cccnc2)nc(C2CC2)c1Br
InChIInChI=1S/C15H17BrN4/c1-2-7-18-15-12(16)13(10-5-6-10)19-14(20-15)11-4-3-8-17-9-11/h3-4,8-10H,2,5-7H2,1H3,(H,18,19,20)
InChIKeyPVWRAUPRORPHMZ-UHFFFAOYSA-N
XLogP4.00
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.23
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-cyclopropyl-5-iodo-N-propyl-2-pyridin-3-ylpyrimidin-4-amine
CID 66304220
5-bromo-6-cyclopropyl-N-methyl-2-pyridin-3-ylpyrimidin-4-amine
CID 66302950
5-bromo-6-propan-2-yl-N-propyl-2-pyridin-3-ylpyrimidin-4-amine
CID 66301103
5-bromo-2-(4-bromo-5-methylthiophen-2-yl)-6-cyclopropyl-N-propylpyrimidin-4-amine
CID 102844082
5-bromo-2-(3-bromo-4-methylphenyl)-6-cyclopropyl-N-ethylpyrimidin-4-amine
CID 105410496
3-[5-bromo-4-cyclopropyl-6-(ethylamino)pyrimidin-2-yl]phenol
CID 66295900
5-bromo-6-cyclopropyl-2-(2,6-dimethyl-4-pyridinyl)-N-ethylpyrimidin-4-amine
CID 107504375
5-bromo-6-cyclopropyl-N-ethyl-2-(3-fluoro-4-methylphenyl)pyrimidin-4-amine
CID 66302548
5-bromo-6-cyclopropyl-2-(2-methylcyclopropyl)-N-propylpyrimidin-4-amine
CID 66304188
5-bromo-6-cyclopropyl-2-(methylsulfanylmethyl)-N-propylpyrimidin-4-amine
CID 66302144
5-bromo-6-cyclopropyl-2-(2,6-dichlorophenyl)-N-ethylpyrimidin-4-amine
CID 66295910
6-ethyl-N-propyl-2-pyridin-3-ylpyrimidin-4-amine
CID 62190215

Frequently Asked Questions

What is the IUPAC name of 5-bromo-6-cyclopropyl-N-propyl-2-pyridin-3-ylpyrimidin-4-amine?
The IUPAC name of 5-bromo-6-cyclopropyl-N-propyl-2-pyridin-3-ylpyrimidin-4-amine (CID 66303575) is 5-bromo-6-cyclopropyl-N-propyl-2-pyridin-3-ylpyrimidin-4-amine.
What is the SMILES notation for 5-bromo-6-cyclopropyl-N-propyl-2-pyridin-3-ylpyrimidin-4-amine?
The canonical SMILES for 5-bromo-6-cyclopropyl-N-propyl-2-pyridin-3-ylpyrimidin-4-amine is CCCNc1nc(-c2cccnc2)nc(C2CC2)c1Br.
What is the InChIKey of 5-bromo-6-cyclopropyl-N-propyl-2-pyridin-3-ylpyrimidin-4-amine?
The InChIKey is PVWRAUPRORPHMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17BrN4/c1-2-7-18-15-12(16)13(10-5-6-10)19-14(20-15)11-4-3-8-17-9-11/h3-4,8-10H,2,5-7H2,1H3,(H,18,19,20).
What are the key properties of 5-bromo-6-cyclopropyl-N-propyl-2-pyridin-3-ylpyrimidin-4-amine?
5-bromo-6-cyclopropyl-N-propyl-2-pyridin-3-ylpyrimidin-4-amine has a molecular weight of 333.23 g/mol, XLogP of 4.00, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-6-cyclopropyl-N-propyl-2-pyridin-3-ylpyrimidin-4-amine is sourced from PubChem (CID 66303575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).