4-(5-bromopyrimidin-2-yl)-1-cyclopropylpiperidin-4-amine

C12H17BrN4 — CID 165458571

IUPAC4-(5-bromopyrimidin-2-yl)-1-cyclopropylpiperidin-4-amine
SMILESNC1(c2ncc(Br)cn2)CCN(C2CC2)CC1
InChIInChI=1S/C12H17BrN4/c13-9-7-15-11(16-8-9)12(14)3-5-17(6-4-12)10-1-2-10/h7-8,10H,1-6,14H2
InChIKeyHFGRSCQFXWHFNA-UHFFFAOYSA-N
MW297.20 g/mol
LogP1.65
Rot. Bonds2

About 4-(5-bromopyrimidin-2-yl)-1-cyclopropylpiperidin-4-amine

4-(5-bromopyrimidin-2-yl)-1-cyclopropylpiperidin-4-amine (PubChem CID 165458571) has the molecular formula C12H17BrN4 and a molecular weight of 297.20 g/mol. Its IUPAC name is 4-(5-bromopyrimidin-2-yl)-1-cyclopropylpiperidin-4-amine.

Molecular Properties

Compound Name4-(5-bromopyrimidin-2-yl)-1-cyclopropylpiperidin-4-amine
PubChem CID165458571
Molecular FormulaC12H17BrN4
Molecular Weight297.20 g/mol
Exact Mass296.06
IUPAC Name4-(5-bromopyrimidin-2-yl)-1-cyclopropylpiperidin-4-amine
SMILESNC1(c2ncc(Br)cn2)CCN(C2CC2)CC1
InChIInChI=1S/C12H17BrN4/c13-9-7-15-11(16-8-9)12(14)3-5-17(6-4-12)10-1-2-10/h7-8,10H,1-6,14H2
InChIKeyHFGRSCQFXWHFNA-UHFFFAOYSA-N
XLogP1.65
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.20
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-(5-bromopyrimidin-2-yl)-1-cyclopropylpiperidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(5-bromopyrimidin-2-yl)oxetan-3-amine;hydrochloride
CID 155970384
7-(5-bromopyrimidin-2-yl)-7-azabicyclo[2.2.1]heptane
CID 131198946
8-bromo-1'-cyclopropylspiro[3H-pyrrolo[2,3-c]quinoline-1,4'-piperidine]-2-one
CID 146482026
[4-(4-bromophenyl)-1-cyclopropylpiperidin-4-yl]methanamine
CID 82308791
5-bromo-2-(4-piperidin-1-ylpiperidin-1-yl)pyridin-3-amine
CID 61227700
4-(2-amino-4-bromophenyl)-1-cyclopropylpiperidine-4-carbaldehyde
CID 166969268
3-(1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-ylsulfonyl)-5-bromopyridin-2-amine
CID 63155054
5-(5-bromopyrimidin-2-yl)-5-azaspiro[2.4]heptane
CID 131000915
[1-(5-bromopyrimidin-2-yl)cyclopentyl]methanamine
CID 130544639
1-(3-bromo-5-methyl-2-pyridinyl)-4-cyclopropylpiperazine
CID 105367783
5-bromo-2-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]pyridine
CID 113234614
1-amino-2-(5-bromopyrimidin-2-yl)-2-methylcyclohexan-1-ol
CID 142668143

Frequently Asked Questions

What is the IUPAC name of 4-(5-bromopyrimidin-2-yl)-1-cyclopropylpiperidin-4-amine?
The IUPAC name of 4-(5-bromopyrimidin-2-yl)-1-cyclopropylpiperidin-4-amine (CID 165458571) is 4-(5-bromopyrimidin-2-yl)-1-cyclopropylpiperidin-4-amine.
What is the SMILES notation for 4-(5-bromopyrimidin-2-yl)-1-cyclopropylpiperidin-4-amine?
The canonical SMILES for 4-(5-bromopyrimidin-2-yl)-1-cyclopropylpiperidin-4-amine is NC1(c2ncc(Br)cn2)CCN(C2CC2)CC1.
What is the InChIKey of 4-(5-bromopyrimidin-2-yl)-1-cyclopropylpiperidin-4-amine?
The InChIKey is HFGRSCQFXWHFNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17BrN4/c13-9-7-15-11(16-8-9)12(14)3-5-17(6-4-12)10-1-2-10/h7-8,10H,1-6,14H2.
What are the key properties of 4-(5-bromopyrimidin-2-yl)-1-cyclopropylpiperidin-4-amine?
4-(5-bromopyrimidin-2-yl)-1-cyclopropylpiperidin-4-amine has a molecular weight of 297.20 g/mol, XLogP of 1.65, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-bromopyrimidin-2-yl)-1-cyclopropylpiperidin-4-amine is sourced from PubChem (CID 165458571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).