5-bromo-N,2-dimethyl-N-pyrrolidin-3-ylpyrimidin-4-amine

C10H15BrN4 — CID 83844947

IUPAC5-bromo-N,2-dimethyl-N-pyrrolidin-3-ylpyrimidin-4-amine
SMILESCc1ncc(Br)c(N(C)C2CCNC2)n1
InChIInChI=1S/C10H15BrN4/c1-7-13-6-9(11)10(14-7)15(2)8-3-4-12-5-8/h6,8,12H,3-5H2,1-2H3
InChIKeyBFGJAPRDHVBDIP-UHFFFAOYSA-N
MW271.16 g/mol
LogP1.35
Rot. Bonds2

About 5-bromo-N,2-dimethyl-N-pyrrolidin-3-ylpyrimidin-4-amine

5-bromo-N,2-dimethyl-N-pyrrolidin-3-ylpyrimidin-4-amine (PubChem CID 83844947) has the molecular formula C10H15BrN4 and a molecular weight of 271.16 g/mol. Its IUPAC name is 5-bromo-N,2-dimethyl-N-pyrrolidin-3-ylpyrimidin-4-amine.

Molecular Properties

Compound Name5-bromo-N,2-dimethyl-N-pyrrolidin-3-ylpyrimidin-4-amine
PubChem CID83844947
Molecular FormulaC10H15BrN4
Molecular Weight271.16 g/mol
Exact Mass270.05
IUPAC Name5-bromo-N,2-dimethyl-N-pyrrolidin-3-ylpyrimidin-4-amine
SMILESCc1ncc(Br)c(N(C)C2CCNC2)n1
InChIInChI=1S/C10H15BrN4/c1-7-13-6-9(11)10(14-7)15(2)8-3-4-12-5-8/h6,8,12H,3-5H2,1-2H3
InChIKeyBFGJAPRDHVBDIP-UHFFFAOYSA-N
XLogP1.35
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 ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-N-methyl-N-piperidin-3-ylpyrimidin-4-amine
CID 66320623
N,5,6-trimethyl-N-pyrrolidin-3-ylpyrimidin-4-amine
CID 83833515
N,5-dimethyl-N-pyrrolidin-3-yl-1H-imidazol-2-amine
CID 106552565
N,3-dimethyl-N-pyrrolidin-3-ylquinoxalin-2-amine
CID 55205906
5-bromo-2-chloro-N-cyclopropyl-N-methylpyrimidin-4-amine
CID 79076587
N,5,6-trimethyl-N-pyrrolidin-3-ylthieno[2,3-d]pyrimidin-4-amine
CID 63301843
N,4-dimethyl-N-[(3R)-pyrrolidin-3-yl]pyridin-2-amine;hydrochloride
CID 71640984
N,2-dimethyl-4-propan-2-yl-N-[(3S)-pyrrolidin-3-yl]pyrimidine-5-carboxamide
CID 124613889
N-methyl-3-methylsulfonyl-N-pyrrolidin-3-ylpyridin-2-amine
CID 114599260
N-methyl-N-[(3R)-pyrrolidin-3-yl]-1,3-thiazol-2-amine;hydrochloride
CID 71641002
3-ethoxy-N-methyl-N-[(3S)-pyrrolidin-3-yl]quinoxalin-2-amine
CID 71639635
3-ethoxy-N-methyl-N-[(3R)-pyrrolidin-3-yl]quinoxalin-2-amine
CID 71639631

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N,2-dimethyl-N-pyrrolidin-3-ylpyrimidin-4-amine?
The IUPAC name of 5-bromo-N,2-dimethyl-N-pyrrolidin-3-ylpyrimidin-4-amine (CID 83844947) is 5-bromo-N,2-dimethyl-N-pyrrolidin-3-ylpyrimidin-4-amine.
What is the SMILES notation for 5-bromo-N,2-dimethyl-N-pyrrolidin-3-ylpyrimidin-4-amine?
The canonical SMILES for 5-bromo-N,2-dimethyl-N-pyrrolidin-3-ylpyrimidin-4-amine is Cc1ncc(Br)c(N(C)C2CCNC2)n1.
What is the InChIKey of 5-bromo-N,2-dimethyl-N-pyrrolidin-3-ylpyrimidin-4-amine?
The InChIKey is BFGJAPRDHVBDIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15BrN4/c1-7-13-6-9(11)10(14-7)15(2)8-3-4-12-5-8/h6,8,12H,3-5H2,1-2H3.
What are the key properties of 5-bromo-N,2-dimethyl-N-pyrrolidin-3-ylpyrimidin-4-amine?
5-bromo-N,2-dimethyl-N-pyrrolidin-3-ylpyrimidin-4-amine has a molecular weight of 271.16 g/mol, XLogP of 1.35, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N,2-dimethyl-N-pyrrolidin-3-ylpyrimidin-4-amine is sourced from PubChem (CID 83844947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).